(1H-Benzimidazol-6-yl)acetonitrile

Base Information

Chemical Name:(1H-Benzimidazol-6-yl)acetonitrile
CAS No.:110925-52-5
Molecular Formula:C9H7 N3
Molecular Weight:157.175
Hs Code.:
European Community (EC) Number:822-685-2
DSSTox Substance ID:DTXSID60551149
Wikidata:Q82430672
Mol file:110925-52-5.mol

Synonyms:110925-52-5;2-(3H-benzimidazol-5-yl)acetonitrile;(1H-Benzimidazol-6-yl)acetonitrile;1H-Benzimidazole-5-acetonitrile(9CI);2-(1H-Benzo[d]imidazol-5-yl)acetonitrile;DTXSID60551149;EN300-1709469;2-(1H-1,3-BENZODIAZOL-5-YL)ACETONITRILE

Suppliers and Price of (1H-Benzimidazol-6-yl)acetonitrile

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Alichem
1H-benzimidazole-5-acetonitrile
1g
$ 1959.22

Alichem
1H-benzimidazole-5-acetonitrile
500mg
$ 1177.86

Alichem
1H-benzimidazole-5-acetonitrile
250mg
$ 809.20

Total 1 raw suppliers

Chemical Property of (1H-Benzimidazol-6-yl)acetonitrile

Chemical Property:

Melting Point:150 °C
Boiling Point:474.6±20.0 °C(Predicted)
PKA:12.23±0.10(Predicted)
PSA：52.47000
Density:1.295±0.06 g/cm3(Predicted)
LogP:1.62898
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:157.063997236
Heavy Atom Count:12
Complexity:205

Purity/Quality:: 1H-benzimidazole-5-acetonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC2=C(C=C1CC#N)NC=N2

Technology Process of (1H-Benzimidazol-6-yl)acetonitrile

There total 6 articles about (1H-Benzimidazol-6-yl)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:

: 857790-34-2
formic acid-(2-amino-4-cyanomethyl-anilide)

: 110925-52-5
(1⁽³⁾H-benzimidazol-5-yl)-acetonitrile

Guidance literature:: With acetic acid;

Reference yield:

: 216063-76-2
4-(N-formylamino) benzyl cyanide

: 110925-52-5
(1⁽³⁾H-benzimidazol-5-yl)-acetonitrile

Guidance literature:: Multi-step reaction with 3 steps

1: fuming nitric acid

2: iron; acetic acid

3: formic acid

With formic acid; nitric acid; iron; acetic acid;