Edexcel International A Level Chemistry

Topic 15: Organic Chemistry: Carbonyls, Carboxylic Acids and Chirality

Mirror-image molecules, the C=O group and everything built on it, and the spectra and chromatography that prove what you have made.

The one idea

A left hand and a right hand have the same parts but do not match. Some molecules are the same: they have the same atoms and bonds, but one is the mirror image of the other. They behave identically in most reactions, yet they rotate plane-polarised light in opposite directions. That is chirality, and it opens this topic.

The rest of the topic follows one functional group, C=O. In an aldehyde or ketone it is attacked by nucleophiles, and the flat C=O group is why some products come out as a mixture of mirror images. Add an –OH to the carbon and you have a carboxylic acid. Swap that –OH for –Cl, –OR or –NH₂ and you have the derivatives: acyl chlorides, esters and amides. The topic ends with the tools for proving a structure: accurate mass, carbon-13 and proton NMR, and chromatography.

Three ideas carry most of the marks:

  1. Chirality and optical activity as evidence. Whether a product keeps its optical activity tells you which mechanism ran (SN1, SN2, or addition to C=O).
  2. The reaction web. From the alcohol or nitrile to the acid, and from the acid to its derivatives, with the reagent and condition for every step.
  3. Putting spectra together. Use accurate mass, carbon-13 NMR and proton NMR together to deduce a structure.
A reaction web with eight boxes. Halogenoalkane to nitrile with KCN. Nitrile to carboxylic acid with dilute HCl under reflux. Primary alcohol to aldehyde with oxidation and distillation, and aldehyde back to alcohol with LiAlH4. Aldehyde to carboxylic acid by oxidation under reflux. Carboxylic acid to acyl chloride with PCl5. Acyl chloride to ester with an alcohol and to an amide with ammonia.
The main routes in this topic. The carboxylic acid is the hub.

The five parts

Part Pages
15A Chirality: chiral centres, drawing enantiomers, optical activity, racemic mixtures and the evidence they give about mechanisms Chiral centres to Optical activity as evidence
15B Carbonyl compounds: naming, physical properties, the oxidation tests, reduction, addition of HCN, 2,4-DNPH and the iodoform test Naming aldehydes and ketones to Practical, identifying carbonyls
15C Carboxylic acids: naming, hydrogen bonding, making them, their reactions and esterification Naming carboxylic acids to Esterification
15D Derivatives: acyl chlorides and esters, their reactions, ester hydrolysis and polyesters Naming acyl chlorides and esters to Polyesters
15E Spectroscopy and chromatography: accurate mass, carbon-13 and proton NMR, TLC, column chromatography, and combining the data Accurate relative molecular mass to Putting the data together

When you have finished, use Topic 15 on a page for a last read.

What you need first

Values used in these notes

Quantity Value
accurate relative atomic masses H 1.0078, C 12.0000, N 14.0031, O 15.9949
TMS reference δ = 0 ppm
carbon-13 shifts C–C 5–55, C–O 50–90, C=C 90–150, C=O in acids and esters 160–185, C=O in aldehydes and ketones 190–220
proton shifts CH₃ 0.7–1.2, CH₂ in a chain 1.2–1.4, next to C=O 2.0–2.7, bonded to O 3.3–4.3, –CHO 9.4–10.0, –COOH 10–12

Check the shift ranges against the data booklet your exam gives you. They are quoted here as typical values.

Pages

  1. Chiral centres

    A carbon atom with four different groups attached is a chiral centre. Its molecule can exist as two mirror-image forms that cannot be placed on top of each other.

    12 min 15.115.2

  2. Drawing enantiomers

    A 3D diagram uses plain lines, a wedge and a dashed line around the chiral carbon. The mirror image swaps left and right while the wedge stays a wedge and the dash stays a dash.

    12 min 15.2

  3. Optical activity and racemic mixtures

    A single enantiomer rotates the plane of plane-polarised light. Its mirror image rotates it by the same angle the other way, so an equal mixture of the two has no effect.

    13 min 15.315.4

  4. Optical activity as evidence for a mechanism

    Start with a single enantiomer and check whether the product is optically active. A reaction that keeps the activity works by SN2, and one that loses it passes through a flat intermediate, as in SN1.

    14 min 15.5

  5. Naming aldehydes and ketones

    Aldehydes end in -al with the C=O on the end carbon. Ketones end in -one with the C=O inside the chain. You need to draw each as structural, displayed and skeletal formulae.

    14 min 15.6

  6. Physical properties of carbonyl compounds

    Aldehydes and ketones have no O–H bond, so they cannot hydrogen-bond to each other and boil lower than alcohols. Their oxygen atom can accept a hydrogen bond from water, so small ones dissolve.

    12 min 15.7(i)15.7(ii)

  7. Oxidation tests for aldehydes

    Aldehydes are easily oxidised to carboxylic acids and ketones are not. Tollens' reagent, Fehling's or Benedict's solution and acidified dichromate(VI) all react with aldehydes and not with ketones.

    14 min 15.8(i)

  8. Reducing carbonyl compounds with LiAlH₄

    Lithium tetrahydridoaluminate(III) in dry ether reduces an aldehyde to a primary alcohol and a ketone to a secondary alcohol. A ketone such as butanone gives a racemic product, because the flat C=O is attacked from both sides.

    12 min 15.8(ii)15.5

  9. Addition of hydrogen cyanide

    Cyanide ion attacks the δ+ carbon of a C=O group in nucleophilic addition, making a hydroxynitrile. Because the C=O group is flat, an aldehyde gives a racemic mixture.

    16 min 15.8(iii)15.5

  10. 2,4-DNPH and the iodoform test

    2,4-dinitrophenylhydrazine gives an orange precipitate with any aldehyde or ketone, and its melting temperature identifies which one. Iodine and alkali give a pale yellow precipitate of triiodomethane with a CH₃CO group.

    15 min 15.8(iv)15.8(v)

  11. Practical, identifying carbonyl compounds

    A sequence of test-tube tests with 2,4-DNPH, Tollens' reagent and iodine and alkali separates aldehydes, methyl ketones, other ketones and alcohols. The melting temperature of the derivative then names the compound.

    15 min 15.8(i)15.8(iv)15.8(v)

  12. Naming carboxylic acids

    A carboxylic acid contains the –COOH group and its name ends in -oic acid. The carboxyl carbon is always carbon 1, so a number is never needed for it.

    11 min 15.9

  13. Hydrogen bonding in carboxylic acids

    A carboxylic acid has both a C=O oxygen to accept and an O–H hydrogen to give hydrogen bonds. This gives high boiling temperatures and, for small acids, complete solubility in water.

    14 min 15.10

  14. Making carboxylic acids

    Carboxylic acids are made by oxidising primary alcohols or aldehydes under reflux with acidified dichromate(VI), or by hydrolysing a nitrile with acid or alkali. The nitrile route lengthens the carbon chain by one carbon.

    16 min 15.11

  15. Reactions of carboxylic acids

    Carboxylic acids are reduced to primary alcohols by lithium tetrahydridoaluminate(III), neutralised by bases to give salts, and converted to acyl chlorides by phosphorus(V) chloride.

    15 min 15.12(i)15.12(ii)15.12(iii)

  16. Esterification

    A carboxylic acid and an alcohol, heated with a little concentrated sulfuric acid as catalyst, form an ester and water in an equilibrium. Esters are named from the alcohol first and the acid second.

    14 min 15.12(iv)

  17. Naming acyl chlorides and esters

    Acyl chlorides end in -oyl chloride and contain –COCl. Esters are named alkyl alkanoate, with the part from the alcohol first and the part from the acid second.

    12 min 15.13

  18. Reactions of acyl chlorides

    Ethanoyl chloride reacts quickly at room temperature with water, alcohols, concentrated ammonia and amines. Each reaction swaps the Cl for –OH, –OR, –NH₂ or –NHR and gives off hydrogen chloride or its salt.

    15 min 15.14(i)15.14(ii)15.14(iii)15.14(iv)

  19. Hydrolysis of esters

    Heating an ester under reflux with dilute acid reverses esterification and gives an equilibrium. Heating it with aqueous sodium hydroxide goes to completion and gives the sodium salt of the acid and the alcohol.

    13 min 15.15

  20. Polyesters

    A polyester forms when a molecule with two –COOH groups reacts with a molecule with two –OH groups. A water molecule is lost at each ester link. Terylene is made from benzene-1,4-dicarboxylic acid and ethane-1,2-diol.

    12 min 15.16

  21. Accurate relative molecular mass

    A high-resolution mass spectrometer measures the molecular ion peak to four decimal places. Atoms do not have whole-number masses, so the exact value tells you the molecular formula.

    14 min 15.17(i)15.17(ii)

  22. Carbon-13 NMR

    Each carbon atom in a different environment gives one peak in a carbon-13 NMR spectrum. The chemical shift of the peak shows what the carbon is bonded to, and the number of peaks shows how many different environments there are.

    15 min 15.1815.19(i)15.19(ii)

  23. Proton NMR, environments and peak areas

    A proton NMR spectrum has one peak for each set of equivalent hydrogen atoms. The chemical shift shows the type of hydrogen and the area under each peak is in the ratio of the number of hydrogens in that environment.

    15 min 15.20(i)15.20(ii)

  24. Splitting and the (n + 1) rule

    At high resolution a peak splits into a pattern. A hydrogen with n hydrogens on the adjacent carbon atoms gives n + 1 lines, with heights in the ratio of Pascal's triangle.

    14 min 15.20(iii)

  25. Predicting and deducing from proton NMR

    To predict a spectrum, find each hydrogen environment and give its shift, area and splitting. To deduce a structure, reverse the process and build pieces that fit every peak, then check them against the formula.

    16 min 15.20(iv)15.20(iii)

  26. Chromatography and Rf values

    Chromatography separates a mixture because its components spend different amounts of time in a moving mobile phase and a fixed stationary phase. In paper and thin-layer chromatography each substance has its own Rf value.

    14 min 15.2115.22

  27. Column chromatography

    High-performance liquid chromatography and gas chromatography pass a mixture through a column. Components leave at different retention times, and the detector, often a mass spectrometer, identifies and measures each.

    13 min 15.23

  28. Putting the data together

    Use accurate mass for the molecular formula, carbon-13 NMR for the number of carbon environments and the functional groups, and proton NMR for the environments, ratio and neighbours. Then assemble a structure that fits every piece.

    16 min 15.17(i)15.19(i)15.20(iv)

Also in this topic: Topic 15 on a page

Spec checklist

Every point you can be examined on in this topic, and where it is explained. Tick them off as you go.

SpecYou should be able toWhere
15.1know that optical isomerism is a result of chirality in molecules with a single chiral centreMirror images that do not match
The rotation test
15.2understand that optical isomerism results from chiral centre(s) in a molecule with asymmetric carbon atom(s) and that optical isomers (enantiomers) are object and non-superimposable mirror images and be able to draw 3D diagrams of these optical isomersFinding the chiral centre
The three kinds of bond
Drawing the mirror image
15.3know that optical activity is the ability of a single optical isomer to rotate the plane of polarisation of plane-polarised monochromatic light in molecules containing a single chiral centrePlane-polarised light
The polarimeter
15.4know what is meant by the term ‘racemic mixture’Racemic mixtures
15.5be able to use data on optical activity of reactants and products as evidence for SN1 and SN2 mechanisms and addition to carbonyl compoundsThe idea
SN2: one step, one side
SN1: a flat intermediate
Reading an exam question
What the product tells you about the C=O group
Optical activity shows the C=O is flat
15.6understand the nomenclature of aldehydes and ketones and be able to draw their structural, displayed and skeletal formulaeThe carbonyl group
Naming rules
Three ways to draw them
15.7(i)understand that aldehydes and ketones: do not form intermolecular hydrogen bonds and this affects their physical propertiesBoiling temperatures
15.7(ii)understand that aldehydes and ketones: can form hydrogen bonds with water and this affects their solubilitySolubility in water
15.8(i)understand the reactions of carbonyl compounds with: Fehling’s or Benedict’s solution, Tollens’ reagent and acidified dichromate(VI) ions. In equations, the oxidising agent can be represented as [O].Why aldehydes oxidise and ketones do not
Tollens' reagent
Fehling's and Benedict's solutions
Acidified dichromate(VI)
Expected observations
15.8(ii)understand the reactions of carbonyl compounds with: lithium tetrahydridoaluminate(III) (lithium aluminium hydride) in dry ether (ethoxyethane). In equations, the reducing agent can be represented by [H].The reagent and the reaction
15.8(iii)understand the reactions of carbonyl compounds with: HCN, in the presence of KCN, as a nucleophilic addition reaction, using curly arrows, relevant lone pairs, dipoles and evidence of optical activity to show the mechanismThe reaction
The mechanism
15.8(iv)understand the reactions of carbonyl compounds with: 2,4-dinitrophenylhydrazine (2,4-DNPH), as a qualitative test for the presence of a carbonyl group and to identify a carbonyl compound given data of the melting temperatures of derivatives. The equation for this reaction is not required.Testing for a carbonyl group
Identifying the carbonyl compound
The further suggested practical
15.8(v)understand the reactions of carbonyl compounds with: iodine in the presence of alkali (the iodoform test)The iodoform test
Following a logical order
15.9understand the nomenclature of carboxylic acids and be able to draw their structural, displayed and skeletal formulaeThe carboxyl group
Naming rules
Salts and substituents
15.10understand that hydrogen bonding affects the physical properties of carboxylic acids, in relation to their boiling temperatures and solubilityBoiling temperatures
Solubility in water
15.11understand that carboxylic acids can be prepared by the oxidation of alcohols or aldehydes and the hydrolysis of nitrilesOxidising alcohols and aldehydes
Hydrolysing a nitrile
15.12(i)understand the reactions of carboxylic acids with: lithium tetrahydridoaluminate(III) (lithium aluminium hydride) in dry ether (ethoxyethane)One acid, four reactions
Reduction to a primary alcohol
15.12(ii)understand the reactions of carboxylic acids with: bases to produce saltsReactions with bases give salts
15.12(iii)understand the reactions of carboxylic acids with: phosphorus(V) chloride (phosphorus pentachloride)Reaction with phosphorus(V) chloride
15.12(iv)understand the reactions of carboxylic acids with: alcohols in the presence of an acid catalystThe reaction
Naming and uses
15.13understand the nomenclature of acyl chlorides and esters and be able to draw their structural, displayed and skeletal formulaeOne C=O part, four groups
Naming acyl chlorides
Naming esters
15.14(i)understand the reactions of acyl chlorides with: waterWhy acyl chlorides react so easily
With water
15.14(ii)understand the reactions of acyl chlorides with: alcoholsWith alcohols
15.14(iii)understand the reactions of acyl chlorides with: concentrated ammoniaWith concentrated ammonia
15.14(iv)understand the reactions of acyl chlorides with: aminesWith amines
15.15understand the hydrolysis reactions of esters, in acidic and alkaline solutionTwo ways to break an ester
Acid hydrolysis
Alkaline hydrolysis
15.16understand how polyesters, such as terylene, are formed by condensation polymerisation reactions.Condensation polymerisation
Terylene
15.17(i)be able to use data from mass spectra to: suggest possible structures of a simple organic compound given accurate relative molecular massesSuggesting a structure
What each technique tells you
15.17(ii)be able to use data from mass spectra to: calculate the accurate relative molecular mass of a compound, given accurate relative atomic masses to four decimal placesWhy four decimal places help
Calculating an accurate relative molecular mass
15.18understand that carbon-13, (¹³C) NMR spectroscopy provides information about the positions of ¹³C atoms in a moleculeWhat carbon-13 NMR measures
15.19(i)be able to use data from ¹³C NMR spectroscopy to: predict the different environments for carbon atoms present in a molecule, given values of chemical shift, δChemical shifts
Worked example, an ester
15.19(ii)be able to use data from ¹³C NMR spectroscopy to: justify the number of peaks present in a ¹³C NMR spectrum in terms of the number of carbon atoms in different environmentsOne peak per environment
15.20(i)be able to use both low and high resolution proton NMR spectroscopy to: predict the different types of proton present in a molecule, given values of chemical shift, δHydrogen environments
Chemical shift
15.20(ii)be able to use both low and high resolution proton NMR spectroscopy to: relate relative peak areas, or ratio number of protons, to the relative numbers of ¹H atoms in different environmentsPeak areas
15.20(iii)be able to use both low and high resolution proton NMR spectroscopy to: deduce the splitting patterns of adjacent, non-equivalent protons using the (n+1) rule and hence suggest the possible structures for a moleculeSplitting at high resolution
Reading the splitting
Deducing a structure
15.20(iv)be able to use both low and high resolution proton NMR spectroscopy to: predict the chemical shifts and splitting patterns of the ¹H atoms in a given moleculePredicting a spectrum
Worked example, a ketone
15.21know that chromatography separates components of a mixture using a mobile phase and a stationary phaseMobile phase and stationary phase
15.22be able to calculate Rf values from one-way chromatograms in paper and thin-layer chromatography (TLC) and understand reasons for differences in Rf valuesPaper and thin-layer chromatography
The Rf value
15.23know that high-performance liquid chromatography, HPLC, and gas chromatography, GC, are types of column chromatography that separate substances because of different retention times in the column and may be used in conjunction with mass spectrometry, in applications such as forensics or drug testing in sportChromatography in a column
Retention time
Using the mass spectrometer as the detector