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Chemistry

Benzene + Ethanoyl Chloride + AlCl₃

FRIEDEL-CRAFTS ACYLATION  ·  EAS MECHANISM  ·  ACETOPHENONE  ·  A-LEVEL & UNIVERSITY ORGANIC CHEMISTRY

Benzene + Ethanoyl Chloride + AlCl₃: The Product, the Mechanism, and What the Exam Wants

The reaction gives acetophenone. But knowing just the product name is not going to get you marks. You need to explain how AlCl₃ generates the electrophile, why the ring attacks it, and why the product does not react again. That is what this guide walks through.

10–13 min read Organic Chemistry Electrophilic Aromatic Substitution A-Level / University

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Short answer: the product is phenylethan-1-one — almost universally called acetophenone. One hydrogen on the benzene ring gets replaced by an ethanoyl group (CH₃CO–), and HCl is released. The reaction type is Friedel-Crafts acylation. Now let us get into how and why, because that is what gets you the marks.

Friedel-Crafts Acylation Electrophilic Aromatic Substitution Acylium Ion Formation Acetophenone / Phenylethan-1-one AlCl₃ as Lewis Acid Catalyst Why No Polysubstitution Acylation vs. Alkylation

The Product — Name, Formula, Structure

The product is phenylethan-1-one. Common name: acetophenone. Molecular formula: C₈H₈O. Structurally, it is a benzene ring with a –COCH₃ group (an ethanoyl or acetyl group) bonded directly to the ring carbon where a hydrogen used to sit. That hydrogen leaves as HCl. The ring stays intact and aromatic.

C₈H₈O Molecular formula of acetophenone
120.15 Molar mass (g/mol)
EAS Reaction type: Electrophilic Aromatic Substitution
HCl By-product released

Acetophenone is a colourless liquid at room temperature. It has a sweet, slightly floral odour — distinctive in the lab. That is not what your exam asks about, but it is a useful memory anchor for the compound.

The Overall Equation

C₆H₆  +  CH₃COCl  —— AlCl₃, anhydrous ——→  C₆H₅COCH₃  +  HCl Benzene + Ethanoyl chloride → Phenylethan-1-one (acetophenone) + Hydrogen chloride

One mole of benzene reacts with one mole of ethanoyl chloride. The AlCl₃ is a catalyst — it is regenerated at the end of the catalytic cycle and not consumed overall. In practice, you use slightly more than catalytic quantities because AlCl₃ also forms a complex with the carbonyl group of the product.

AlCl₃ Must Be Anhydrous — Not Just “Dry”

Anhydrous literally means without water. AlCl₃ reacts with moisture — even humidity in air is enough to partially destroy it. Water reacts with AlCl₃ to form aluminium hydroxide, deactivating its Lewis acid function. That is why this reaction must be set up under completely dry conditions. Exam answer to “why anhydrous?”: water reacts with AlCl₃ to form Al(OH)₃, removing the catalyst before the reaction completes.

What AlCl₃ Actually Does

AlCl₃ is a Lewis acid — it accepts electron pairs. Aluminium in AlCl₃ has only six electrons around it. That empty orbital is what makes it reactive. When AlCl₃ meets ethanoyl chloride, the chlorine lone pair on the C–Cl bond donates into that empty orbital. The C–Cl bond breaks heterolytically, generating the acylium ion [CH₃CO]⁺ and the tetrachloroaluminate anion [AlCl₄]⁻.

Step 1 AlCl₃ accepts a lone pair from the Cl of ethanoyl chloride. An Al–Cl bond forms, weakening the C–Cl bond in the acyl chloride.
Step 2 The C–Cl bond breaks heterolytically. The acylium ion [CH₃CO]⁺ forms along with [AlCl₄]⁻. The acylium ion is stabilized by resonance: the positive charge is delocalized between C and O.
Step 3 The acylium ion [CH₃CO]⁺ is the electrophile. It attacks the electron-rich π system of benzene.
Step 4 A carbocation intermediate forms — the Wheland intermediate (arenium ion). The ring temporarily loses its aromaticity at the attacked carbon.
Step 5 [AlCl₄]⁻ removes a proton from the ring carbon. Aromaticity is restored. AlCl₃ is regenerated. HCl is released as a by-product.
The Acylium Ion — Why It Matters

[CH₃CO]⁺ Is the Electrophile — Not Ethanoyl Chloride Itself

Many students write that ethanoyl chloride attacks benzene directly. That is not what happens. AlCl₃ generates the acylium ion first. That ion is what attacks the ring. The acylium ion has a very electron-deficient carbon — ideal for targeting the electron-rich benzene π system. Resonance stabilization (CH₃–C≡O⁺ ↔ CH₃–C⁺=O) makes it stable enough to persist before reacting.

Exam tip: If asked to identify the electrophile in Friedel-Crafts acylation, the answer is the acylium ion [CH₃CO]⁺ — not AlCl₃ and not ethanoyl chloride itself.

The EAS Mechanism — Step by Step

Friedel-Crafts acylation is a type of electrophilic aromatic substitution (EAS). Every EAS reaction follows the same two-stage pattern: electrophilic addition to form the Wheland intermediate, then elimination to restore aromaticity. Aromaticity is the thermodynamic driver — the ring wants to return to its fully delocalized, stable state.

1

Electrophile Generation — AlCl₃ Activates the Acyl Chloride

AlCl₃ coordinates with the chlorine on ethanoyl chloride and breaks the C–Cl bond heterolytically, generating [CH₃CO]⁺ and [AlCl₄]⁻. Without this step, ethanoyl chloride is not electrophilic enough to attack benzene on its own.

2

Electrophilic Attack — The Acylium Ion Attacks the π System

The electron-deficient acylium ion [CH₃CO]⁺ approaches the electron-rich benzene ring. Two electrons from the delocalized π system attack the acylium carbon. A new C–C bond forms between a ring carbon and the acyl carbon.

3

Wheland Intermediate — Aromaticity Temporarily Lost

The attacked ring carbon is now sp³ hybridized — it has four bonds. The ring is no longer fully aromatic. The positive charge is delocalized around the remaining five carbons. This intermediate is less stable than benzene, driving the next step.

4

Proton Loss — Aromaticity Restored, HCl and AlCl₃ Released

[AlCl₄]⁻ acts as a base and removes the proton from the sp³ carbon. The full π system is restored, AlCl₃ is regenerated, and HCl is released. The aromatic product — acetophenone — is stable.

Why Substitution and Not Addition?

The ring does form an addition intermediate (the Wheland intermediate), but the overall reaction is substitution. The reason: aromaticity. The ring would permanently lose its stability if it stayed in the addition state. Ejecting the proton and restoring the π system is the thermodynamic payoff that drives the overall reaction. That is why EAS always ends as substitution, not addition.

Why the Reaction Stops at Monosubstitution

This is one of the most important points in Friedel-Crafts chemistry — and one of the biggest advantages of acylation over alkylation.

The Deactivating Effect of the Acyl Group

The Product Deactivates Itself Toward Further Electrophilic Attack

The acyl group (–COCH₃) is an electron-withdrawing group. Through induction and conjugation, the carbonyl carbon pulls electron density away from the ring. A ring with less electron density is less attractive to electrophiles. So the product is actually harder to acylate than the starting benzene. Under normal conditions, you get clean monosubstitution and nothing else.

Also worth noting: AlCl₃ forms a stable complex with the carbonyl group of acetophenone. This ties up some of the catalyst and further suppresses any second substitution. It is also why you often need a slight excess of AlCl₃ in practice.

Acylation vs. Alkylation — Key Differences

Both reactions use AlCl₃ and proceed through EAS. Both attach a carbon group to benzene. But they differ in ways that come up repeatedly in organic chemistry courses.

Feature Acylation Alkylation
Reagent Acyl chloride (e.g., CH₃COCl) Alkyl halide (e.g., CH₃CH₂Cl)
Electrophile Acylium ion [RCO]⁺ Carbocation [R]⁺
Product group on ring Ketone (–COR) Alkyl group (–R)
Polysubstitution? No — acyl group deactivates ring Yes — alkyl group activates ring
Carbocation rearrangements? No — acylium ion is resonance-stabilized Yes — carbocations can rearrange
Selectivity High — clean monosubstitution Lower — mixture of products common

This selectivity advantage is why acylation is often the first step in a multi-step aromatic synthesis. Acylate to attach a carbon chain cleanly. Then reduce the ketone to a methylene group (Clemmensen or Wolff-Kishner reduction) if you need an alkyl group. Two steps, but far more predictable than direct Friedel-Crafts alkylation.

Conditions and Practical Notes

What the Reaction Requires

  • Benzene — as solvent and reactant
  • Ethanoyl chloride (acetyl chloride) — the acylating agent
  • Anhydrous AlCl₃ — Lewis acid catalyst; must be kept dry throughout
  • Dry conditions — drying tube or inert gas atmosphere to exclude moisture
  • Reflux or mild warming — temperature conditions depend on the specific substrate

What Comes Out

  • Acetophenone — the product; separated by distillation after aqueous workup
  • HCl gas — acidic fumes released during the reaction; requires venting or scrubbing
  • AlCl₃ complex — the catalyst complexes with the product carbonyl and is released on careful aqueous workup
The By-product Is HCl, Not Water

Students sometimes write that water is released. It is not. The leaving group from the electrophile is Cl⁻ (from [AlCl₄]⁻), and the proton removed from the ring combines with it to form HCl. No oxygen is involved in that step. Water as a by-product would mean a condensation reaction. This is a substitution reaction. The by-product from Friedel-Crafts acylation using an acyl chloride is always HCl.

Exam Mistakes to Avoid

Writing that ethanoyl chloride directly attacks benzene

It does not. AlCl₃ must generate the acylium ion first. The electrophile is [CH₃CO]⁺, not CH₃COCl. Missing this step in a mechanism answer loses marks.

Draw acylium ion formation as your first step

Show CH₃COCl + AlCl₃ → [CH₃CO]⁺ + [AlCl₄]⁻ before the ring gets involved. That is where the mechanism starts.

Stopping the mechanism at the Wheland intermediate

The Wheland intermediate is not the product. If you leave the mechanism there, you have drawn addition, not substitution. The ring must lose a proton to restore aromaticity.

Always show the deprotonation step

Draw [AlCl₄]⁻ removing H⁺ from the Wheland intermediate. Show curly arrows from the C–H bond to form HCl and regenerate AlCl₃. That completes the mechanism.

Calling AlCl₃ a Bronsted acid

AlCl₃ does not donate protons. It is a Lewis acid — an electron pair acceptor. Calling it a Bronsted acid is a factual error that exam markers will catch.

State AlCl₃ is a Lewis acid with an empty orbital

Aluminium has only six electrons — an empty 3p orbital. It accepts the lone pair from the chlorine in C–Cl. That is Lewis acid behaviour. Be explicit about this in your answer.

Writing the product name without checking the IUPAC format

“Phenylethanone” is incomplete. The correct IUPAC name is phenylethan-1-one. If the question asks for the IUPAC name, include the locant.

Know both names and draw the structure

Phenylethan-1-one = acetophenone = C₆H₅COCH₃. You should be able to draw the benzene ring with a C=O and CH₃ attached from any of those names.

Frequently Asked Questions

What is the IUPAC name of the product when benzene reacts with ethanoyl chloride and AlCl₃?
The IUPAC name is phenylethan-1-one. The common name is acetophenone. The structure is a benzene ring with an ethanoyl group (–COCH₃) directly bonded to one ring carbon. The molecular formula is C₈H₈O and the molar mass is 120.15 g/mol.
Why is AlCl₃ described as a catalyst if you need more than one equivalent in practice?
AlCl₃ is regenerated within the catalytic cycle — it is not consumed in the bond-making step. However, the product (acetophenone) has a carbonyl group that forms a stable complex with AlCl₃, tying up some catalyst until aqueous workup breaks the complex. So technically it is a catalyst, but in practice a slight excess is needed. Most exam-level questions treat it simply as a catalyst; focus on that framing.
What would happen if you used ethanoic acid instead of ethanoyl chloride with AlCl₃?
The reaction would not work cleanly. Ethanoic acid is a much poorer acylating agent. The C–OH bond in a carboxylic acid is far harder to activate than the C–Cl bond in an acyl chloride. AlCl₃ can react with the –OH group rather than generating a useful acylium ion. In practice, Friedel-Crafts acylation uses acyl chlorides or acid anhydrides — carboxylic acids alone do not give a reliable reaction with benzene under these conditions.
Is the acyl group ortho/para or meta directing for subsequent reactions?
The acyl group (–COCH₃) is a meta director. It is an electron-withdrawing group that withdraws electron density preferentially from the ortho and para positions, making meta relatively more electron-rich. This matters if you carry out a second EAS reaction on the acetophenone product. However, because the acyl group deactivates the ring overall, further substitution is already slow under Friedel-Crafts conditions anyway.
How would you convert acetophenone to ethylbenzene?
Reduce the carbonyl group. Two standard methods: Clemmensen reduction (zinc amalgam and concentrated HCl — acidic conditions, converts C=O to CH₂) or Wolff-Kishner reduction (hydrazine and base at high temperature — basic conditions, better for acid-sensitive substrates). Both convert the ketone carbonyl to a methylene group, giving ethylbenzene (C₆H₅CH₂CH₃). This acylation-then-reduction route is preferred over direct Friedel-Crafts alkylation because it avoids carbocation rearrangements.
Can this reaction be carried out on substituted benzenes?
Yes. Electron-donating substituents like –CH₃ (as in toluene) activate the ring and direct the incoming acyl group to the ortho and para positions — you typically get a mixture of 2-methyl and 4-methyl products, with para predominating. Electron-withdrawing substituents like –NO₂ deactivate the ring and can prevent Friedel-Crafts acylation from working at all. Nitrobenzene is actually often used as a solvent in Friedel-Crafts reactions precisely because it is too deactivated to react with the electrophile.
What is the difference between an acyl chloride and an acylium ion?
An acyl chloride (like ethanoyl chloride, CH₃COCl) is a neutral molecule — the reagent you add to the flask. An acylium ion ([CH₃CO]⁺) is the positively charged electrophile generated when AlCl₃ removes the chloride. The acylium ion is what attacks benzene. Ethanoyl chloride on its own is not electrophilic enough to react with benzene without Lewis acid activation. Confusing the two in a mechanism answer is a reliable way to drop marks.

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Putting It All Together

Benzene + ethanoyl chloride + anhydrous AlCl₃ gives acetophenone (phenylethan-1-one) + HCl. That is the answer. But the understanding that matters is in the mechanism: AlCl₃ generates the acylium ion, the acylium ion attacks the π system, the Wheland intermediate loses a proton to restore aromaticity, and AlCl₃ is regenerated.

Two features make acylation cleaner than alkylation. First, acylium ions do not rearrange (unlike carbocations in alkylation). Second, the product deactivates the ring, so you get one substitution and it stops. No messy polysubstitution. No rearranged products. That predictability is why Friedel-Crafts acylation is one of the most useful reactions in aromatic synthesis.

When your exam shows benzene + an acyl chloride + AlCl₃, you know: reaction type is EAS / Friedel-Crafts acylation; the electrophile is the acylium ion; the product is an aryl ketone; the by-product is HCl. Draw the mechanism step by step — curly arrows from π system to electrophile, Wheland intermediate, proton removal, ring restored. That sequence, drawn carefully, is what earns full marks.

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