Benzeneacetonitrile, .alpha.-broMo-2-chloro-

Base Information

• Chemical Name: Benzeneacetonitrile, .alpha.-broMo-2-chloro-
• CAS No.: 444891-19-4
• Molecular Formula: C8H5BrClN
• Molecular Weight: 230.491
• Mol file: 444891-19-4.mol

Synonyms:BENZENEACETONITRILE,.ALPHA.-BROMO-2-CHLORO-;2-BROMO-2-(2-CHLOROPHENYL)ACETONITRILE;(+/-);

Chemical Property of Benzeneacetonitrile, .alpha.-broMo-2-chloro-

Chemical Property:

• Boiling Point: 260.4±25.0 °C(Predicted)
• PSA: 23.79000
• Density: 1.628±0.06 g/cm3(Predicted)
• LogP: 3.29958

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of Benzeneacetonitrile, .alpha.-broMo-2-chloro-

There total 1 articles about Benzeneacetonitrile, .alpha.-broMo-2-chloro- 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: 96.0%

2-Chlorophenylacetonitrile (2856-63-5) → 2-bromo-2-(2-chlorophenyl)acetonitrile (444891-19-4)

Guidance literature:

With bromine; at 110 ℃; for 6h;

Reference yield: 85.0%

4,5,6,7-tetrahydrothieno[3,2-c]pyridine (54903-50-3) + 2-bromo-2-(2-chlorophenyl)acetonitrile (444891-19-4) → 2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridine-5(4H)-yl)acetonitrile (444728-11-4)

Guidance literature:

With sodium hydrogencarbonate; In methanol; for 3h; Reflux;

Reference yield: 85.0%

2-bromo-2-(2-chlorophenyl)acetonitrile (444891-19-4) + 6,7-dihydro-4H-thieno[3,2-c]pyridine hydrochloride (28783-41-7) → 2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridine-5(4H)-yl)acetonitrile (444728-11-4)

Guidance literature:

With sodium hydrogencarbonate; In methanol; for 3h; Product distribution / selectivity; Heating / reflux;

upstream raw materials:

2-Chlorophenylacetonitrile

Downstream raw materials:

2-(2-chlorophenyl)-2-(6,7-dihydrothieno[3,2-c]pyridine-5(4H)-yl)acetonitrile

clopidogrel

(S)-(+)-clopidogrel

cis-5-thiol metabolite