2-Bromo-5-methyl-4-phenylnicotinonitrile

Base Information

Chemical Name:2-Bromo-5-methyl-4-phenylnicotinonitrile
CAS No.:65996-21-6
Molecular Formula:C₁₃H₉BrN₂
Molecular Weight:273.132
Hs Code.:
DSSTox Substance ID:DTXSID101226858

Synonyms:2-Bromo-5-methyl-4-phenylnicotinonitrile;65996-21-6;DTXSID101226858;3-Pyridinecarbonitrile, 2-bromo-5-methyl-4-phenyl-

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 2-Bromo-5-methyl-4-phenylnicotinonitrile

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:271.99491
Heavy Atom Count:16
Complexity:277

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CN=C(C(=C1C2=CC=CC=C2)C#N)Br

Technology Process of 2-Bromo-5-methyl-4-phenylnicotinonitrile

There total 3 articles about 2-Bromo-5-methyl-4-phenylnicotinonitrile 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:

: 65996-15-8
4-Dimethylamino-3-methyl-2-phenyl-1,3-butadien-1,1-dicarbonitril

: 65996-21-6
2-bromo-5-methyl-4-phenylnicotinonitrile

Guidance literature:: With hydrogen bromide; In acetic acid; at 55 ℃; for 0.75h;
DOI:10.1021/ol4025265

Reference yield:

: 10432-39-0
2-(1-phenylpropylidene)malononitrile

: 65996-21-6
2-bromo-5-methyl-4-phenylnicotinonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: acetic anhydride / toluene / 24 h

2: hydrogen bromide / acetic acid / 0.75 h / 55 °C

With hydrogen bromide; acetic anhydride; In acetic acid; toluene;
DOI:10.1021/ol4025265