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Organic Chemistry Reading Time: 12 min Free Radical Reaction

The Allylic Bromination Niche: A Special Free Radical Reaction

Master selective bromination at allylic position using N-Bromosuccinimide (NBS) - A crucial tool for JEE Organic Chemistry.

95%
Selectivity
3-4
JEE Marks
4
Key Steps
NBS
Special Reagent

Why Allylic Bromination is Special

Allylic bromination using N-Bromosuccinimide (NBS) is one of the most selective free radical reactions in organic chemistry. Unlike regular bromination that adds across double bonds, NBS specifically targets the allylic position - the carbon adjacent to the double bond.

🎯 JEE Importance

This reaction appears in 1-2 questions per JEE paper, testing understanding of free radical mechanisms, stability of intermediates, and selective organic transformations.

🚀 Quick Navigation

1. Understanding N-Bromosuccinimide (NBS)

The Special Brominating Agent

NBS Structure

N-Bromosuccinimide

O=C(NBr)C(=O)NC
A cyclic bromoamide that provides
low concentration of Br₂

Key Features

  • Provides low, constant concentration of Br₂
  • Prevents addition reaction to double bond
  • Facilitates selective free radical substitution
  • Works under mild conditions (light or peroxide)

Why Not Use Br₂ Directly?

Feature Br₂ (Direct) NBS
Reaction Type Electrophilic Addition Free Radical Substitution
Position Across double bond Allylic position only
Selectivity Low High (95%+)
Br₂ Concentration High Low and constant

2. The Free Radical Mechanism

Step-by-Step Mechanism

Step 1: Initiation - Br₂ Generation

NBS reacts with traces of HBr to generate low concentration of Br₂:

NBS + HBr → Succinimide + Br₂

Light or peroxide generates Br• radicals:

Br₂ → 2Br• (under light/Δ)

Step 2: Hydrogen Abstraction

Br• radical abstracts hydrogen from allylic position:

CH₃-CH=CH₂ + Br• → •CH₂-CH=CH₂ + HBr

Forms resonance-stabilized allylic radical

Step 3: Resonance Stabilization

The allylic radical is stabilized by resonance:

•CH₂-CH=CH₂ ↔ CH₂=CH-CH₂•

This resonance stabilization makes the reaction selective for allylic position

Step 4: Bromine Atom Transfer

The allylic radical reacts with Br₂ to form product and regenerate Br•:

•CH₂-CH=CH₂ + Br₂ → BrCH₂-CH=CH₂ + Br•

The chain reaction continues until all NBS is consumed

Complete Reaction Example

Propene + NBS → 3-Bromopropene

CH₃-CH=CH₂
Propene
+ NBS →
BrCH₂-CH=CH₂
3-Bromopropene

3. Understanding Selectivity & Regiochemistry

Why Allylic Position?

Resonance Stabilization

Allylic radicals are stabilized by resonance, making them more stable than other radical positions:

  • Allylic radical: Resonance stabilized
  • Primary radical: Less stable
  • Vinylic radical: Less stable (sp² hybridized)

Bond Dissociation Energies

Bond Type Energy (kcal/mol)
Allylic C-H ~88
Primary C-H ~101
Vinylic C-H ~111

Regiochemistry in Unsymmetrical Alkenes

Example: 1-Butene with NBS

Two possible allylic positions lead to two products:

CH₃-CH₂-CH=CH₂
1-Butene
↓ NBS
CH₃-CHBr-CH=CH₂ (Major)
More substituted
+
BrCH₂-CH₂-CH=CH₂ (Minor)
Less substituted

The more substituted allylic position is preferred due to greater radical stability

💡 Key Selectivity Rules

  • Allylic > Benzylic > Tertiary > Secondary > Primary > Methyl > Vinylic
  • More substituted allylic positions are preferred
  • Symmetrical alkenes give single product
  • Unsymmetrical alkenes give mixture (follow radical stability)

4. Reaction Conditions & Limitations

Optimal Conditions

Required Conditions

  • Initiator: Light (hv) or Peroxides (ROOR)
  • Solvent: CCl₄ (inert, non-nucleophilic)
  • Temperature: Room temperature or reflux
  • Atmosphere: Often under N₂ to prevent O₂ inhibition

What Doesn't Work

  • Alkanes without allylic positions
  • Compounds with only vinylic hydrogens
  • In presence of strong nucleophiles
  • Under ionic conditions (gives addition)

Common Mistakes to Avoid

Using high concentration of Br₂

Leads to addition reaction instead of substitution

Forgetting the initiator

Reaction won't start without light or peroxide

Wrong solvent choice

Polar solvents can lead to side reactions

5. Practice Problems

Test Your Understanding

Problem 1: Predict the product when cyclohexene reacts with NBS in CCl₄ under light.

Hint: Look for allylic positions in the ring

Problem 2: Why does NBS give substitution while Br₂ gives addition with alkenes?

Hint: Think about Br₂ concentration and reaction mechanism

Problem 3: Predict all possible products when 2-pentene reacts with NBS.

Hint: Identify all allylic positions and their relative stability

Problem 4: Explain why vinylic bromination doesn't occur with NBS.

Hint: Consider bond strengths and radical stability

JEE Tip

Always draw the resonance structures of allylic radicals - this is frequently asked in JEE to test fundamental understanding.

📋 Quick Reference Guide

Key Features

  • Reagent: N-Bromosuccinimide (NBS)
  • Mechanism: Free radical substitution
  • Position: Allylic carbons only
  • Conditions: Light/peroxide, CCl₄
  • Selectivity: 95%+ for allylic position

Mechanism Steps

  1. Br₂ generation from NBS + HBr
  2. Initiation: Br• formation
  3. Propagation: H-abstraction → allylic radical
  4. Resonance stabilization
  5. Product formation + chain continuation

Common Substrates

Propene
→ 3-Bromopropene
Cyclohexene
→ 3-Bromocyclohexene
Toluene
→ Benzyl bromide
1-Butene
→ 1-Bromo-2-butene

🎯 JEE Exam Strategy

Mechanism First

Always start by writing the free radical mechanism - it helps predict products correctly.

🔍
Identify Allylic Positions

Quickly mark all allylic carbons before predicting products.

Check Resonance

Draw resonance structures for allylic radicals - often asked directly.

📝
Conditions Matter

Mention "light or peroxide" and "CCl₄ solvent" for complete answers.

Mastered Allylic Bromination?

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