2-(2-Bromophenyl)-2-(dimethylamino)acetonitrile

Base Information

• Chemical Name: 2-(2-Bromophenyl)-2-(dimethylamino)acetonitrile
• CAS No.: 299215-38-6
• Molecular Formula: C10H11BrN2
• Molecular Weight: 239.115
• Hs Code.: 2926909090
• DSSTox Substance ID: DTXSID30443143
• Mol file: 299215-38-6.mol

Synonyms:2-(2-Bromophenyl)-2-(dimethylamino)acetonitrile;299215-38-6;(2-Bromophenyl)(dimethylamino)acetonitrile;F2189-0163;DTXSID30443143;ZLA21538;MFCD09878365;AKOS009987759;SB76808;BS-25279;CS-0450689;EN300-84691;A876355;J-017694

Chemical Property of 2-(2-Bromophenyl)-2-(dimethylamino)acetonitrile

Chemical Property:

• PSA: 27.03000
• LogP: 2.57538
• Storage Temp.: 2-8°C
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 238.01056
• Heavy Atom Count: 13
• Complexity: 206

Purity/Quality:

97% ^*data from raw suppliers

(2-Bromophenyl)(dimethylamino)acetonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C(C#N)C1=CC=CC=C1Br

Technology Process of 2-(2-Bromophenyl)-2-(dimethylamino)acetonitrile

There total 1 articles about 2-(2-Bromophenyl)-2-(dimethylamino)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: 87.0%

sodium cyanide (143-33-9,25596-52-5) + N,N-dimethylammonium chloride (506-59-2) + ortho-bromobenzaldehyde (6630-33-7) → 2-(2-bromophenyl)-2-(N,N-dimethylamino)acetonitrile (299215-38-6)

Guidance literature:

In water; acetonitrile; at 20 ℃; for 48h;

DOI:10.1021/jo0002700

Reference yield: 87.0%

2-bromobenzylchloride (578-51-8) + 2-(2-bromophenyl)-2-(N,N-dimethylamino)acetonitrile (299215-38-6) → (E)-1,2-bis(2-bromophenyl)-N,N-dimethylethenylamine (299215-65-9)

Guidance literature:

With sodium hydride; In N,N-dimethyl-formamide; at -19 - 20 ℃;

DOI:10.1021/jo0002700

Reference yield: 85.0%

2-(bromomethyl)-5-ethoxy-1,3-difluorobenzene (1017779-51-9) + 2-(2-bromophenyl)-2-(N,N-dimethylamino)acetonitrile (299215-38-6) → 1-(2-bromophenyl)-2-(4-ethoxy-2,6-difluorophenyl)ethanone

Guidance literature:

2-(2-bromophenyl)-2-(N,N-dimethylamino)acetonitrile; With sodium hydride; In N,N-dimethyl-formamide; at -20 ℃; for 2h;

2-(bromomethyl)-5-ethoxy-1,3-difluorobenzene; In N,N-dimethyl-formamide; at -20 - 20 ℃;

upstream raw materials:

sodium cyanide

N,N-dimethylammonium chloride

ortho-bromobenzaldehyde

Downstream raw materials:

(E)-2-(2-bromo-4,5-methylenedioxyphenyl)-1-(2-bromophenyl)-N,N-dimethylethenylamine

(E)-2-(2-bromo-4,5-dimethoxyphenyl)-1-(2-bromophenyl)-N,N-dimethylethenylamine

o-bromo-N,N'-dimethylbenzamide

(E)-1,2-bis(2-bromophenyl)-N,N-dimethylethenylamine