Haloalkanes and Haloarenes: Real-World Scenarios (2)

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Question

Why is chlorobenzene less reactive than methyl chloride toward nucleophilic substitution? Predict the products and conditions for the reaction of chlorobenzene with NaOHNaOH.

Solution — Step by Step

C-Cl in chlorobenzene: stronger (partial double-bond character due to resonance with benzene ring).

C-Cl in methyl chloride: simple sigma bond, weaker.

In chlorobenzene, the lone pair on Cl delocalises into the ring, giving the C-Cl bond partial double-bond character. The bond is shorter and stronger, resisting nucleophilic attack.

Also, the carbon in chlorobenzene is sp2sp^2 hybridised, holding the bond pair more tightly than the sp3sp^3 carbon in methyl chloride. Plus, the ring’s π\pi electrons electrostatically repel incoming nucleophiles.

Chlorobenzene resists ordinary NaOHNaOH. Forcing conditions: 623623 K, 300300 atm pressure, fused NaOHNaOH. Product: sodium phenoxide C6H5ONa+C_6H_5O^-Na^+, which on acidification gives phenol.

This is the Dow process for industrial phenol synthesis.

Final answer: chlorobenzene + NaOHNaOH at 623623 K, 300300 atm → sodium phenoxide → phenol on acidification.

Why This Works

The aromatic ring stabilises the C-Cl bond through resonance. Three resonance structures place the negative charge on ortho and para carbons, making the C-Cl bond effectively “double-bond-like” with about 1.41.4 bond order.

Methyl chloride has none of this — the bond is a clean single bond and is easily attacked by OHOH^-.

Alternative Method

Use Hammond’s postulate. The transition state for SNS_N on chlorobenzene requires breaking aromaticity, which has high activation energy. The transition state for SNS_N on methyl chloride preserves nothing aromatic, so it’s much lower in energy.

NEET 2021 asked exactly why chlorobenzene resists nucleophilic substitution. The four reasons (resonance, sp2sp^2 C, ring π\pi repulsion, instability of phenyl carbanion) earn one mark each.

Common Mistake

Saying “chlorobenzene is more reactive because of resonance”. Resonance stabilises the C-Cl bond, making it less reactive. Resonance increases reactivity only when the substrate has electron-withdrawing groups in ortho/para positions activating the ring toward nucleophilic attack.

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