2-(2-(Bromomethyl)phenyl)acetonitrile

Base Information

• Chemical Name: 2-(2-(Bromomethyl)phenyl)acetonitrile
• CAS No.: 73217-11-5
• Molecular Formula: C9H8BrN
• Molecular Weight: 210.073
• DSSTox Substance ID: DTXSID70447680
• Mol file: 73217-11-5.mol

Synonyms:2-(2-(Bromomethyl)phenyl)acetonitrile;73217-11-5;Benzeneacetonitrile, 2-(bromomethyl)-;2-[2-(bromomethyl)phenyl]acetonitrile;o-bromomethylphenylacetonitrile;SCHEMBL1716296;DTXSID70447680;YCA21711;MFCD00462772;DS-19834;C76332;A925838

Chemical Property of 2-(2-(Bromomethyl)phenyl)acetonitrile

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 208.98401
• Heavy Atom Count: 11
• Complexity: 158

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)CC#N)CBr

Technology Process of 2-(2-(Bromomethyl)phenyl)acetonitrile

There total 5 articles about 2-(2-(Bromomethyl)phenyl)acetonitrile which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

2-tolylmethylnitrile (22364-68-7) → (2-bromomethylphenyl)acetonitrile (73217-11-5)

Guidance literature:

With N-Bromosuccinimide; dibenzoyl peroxide; In tetrachloromethane; Reflux;

Reference yield:

(2-methoxymethyl-phenyl)-acetonitrile (408535-88-6) → (2-bromomethylphenyl)acetonitrile (73217-11-5)

Guidance literature:

With hydrogen bromide; at 150 ℃;

Reference yield:

1,2-bis(methoxymethyl)benzene (5707-27-7) → (2-bromomethylphenyl)acetonitrile (73217-11-5)

Guidance literature:

Multi-step reaction with 2 steps

1: zinc chloride; tetrachloromethane / Erhitzen des Reaktionsprodukts mit Kaliumcyanid in wss. Aethanol

2: aqueous hydrobromic acid / 150 °C

With tetrachloromethane; hydrogen bromide; zinc(II) chloride;

upstream raw materials:

(2-methoxymethyl-phenyl)-acetonitrile

1,2-bis(methoxymethyl)benzene

α,α'-dibromo-o-xylene

2-tolylmethylnitrile

Downstream raw materials:

(2-Isothiocyanatomethyl-phenyl)-acetonitrile

2-(2-(azidomethyl)phenyl)acetonitrile

ethyl ester of N-<(2-cyanomethyl)benzyl>anthranilic acid

[(2-cyanomethyl-benzyl)-p-tolyl-amino]-acetic acid methyl ester