3-(1H-benzimidazol-1-yl)propanenitrile

Base Information

Chemical Name:3-(1H-benzimidazol-1-yl)propanenitrile
CAS No.:4414-84-0
Molecular Formula:C₁₀H₉N₃
Molecular Weight:171.202
Hs Code.:2933990090
DSSTox Substance ID:DTXSID00388193
Wikidata:Q82182972
ChEMBL ID:CHEMBL1711679
Mol file:4414-84-0.mol

Synonyms:4414-84-0;3-(1H-benzimidazol-1-yl)propanenitrile;3-Benzoimidazol-1-yl-propionitrile;3-(benzimidazol-1-yl)propanenitrile;3-(1H-1,3-benzodiazol-1-yl)propanenitrile;SMR000066367;Enamine_005562;EC-000.1498;N-(cyanoethyl)benzimidazole;MLS000056745;F1076-0052;CHEMBL1711679;SCHEMBL11067774;1H-benzimidazole-1-propionitrile;DTXSID00388193;3-Benzoimidazol-1-ylpropionitrile;HCNGGCURDWJVBE-UHFFFAOYSA-N;HMS1409M18;HMS2163M17;HMS3309B02;MFCD00817166;STK737910;AKOS000206566;LS-08339;3-(1H-benzo[d]imidazol-1-yl)propanenitrile;BB 0219653;FT-0635279;EN300-05879;Z53116462;1-METHYL-4-NITRO-1H-PYRROLE-2-CARBONYLCHLORIDE

Suppliers and Price of 3-(1H-benzimidazol-1-yl)propanenitrile

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

TRC
3-(1H-benzimidazol-1-yl)propanenitrile
250mg
$ 155.00

TRC
3-(1H-benzimidazol-1-yl)propanenitrile
25mg
$ 45.00

Matrix Scientific
3-Benzoimidazol-1-yl-propionitrile 95%+
5g
$ 699.00

Matrix Scientific
3-Benzoimidazol-1-yl-propionitrile 95%+
1g
$ 213.00

Matrix Scientific
3-Benzoimidazol-1-yl-propionitrile 95%+
2.500g
$ 461.00

Biosynth Carbosynth
3-(1H-Benzimidazol-1-yl)propanenitrile
2 g
$ 289.00

Biosynth Carbosynth
3-(1H-Benzimidazol-1-yl)propanenitrile
1 g
$ 170.00

Biosynth Carbosynth
3-(1H-Benzimidazol-1-yl)propanenitrile
500 mg
$ 100.00

Biosynth Carbosynth
3-(1H-Benzimidazol-1-yl)propanenitrile
250 mg
$ 57.50

Biosynth Carbosynth
3-(1H-Benzimidazol-1-yl)propanenitrile
5 g
$ 578.00

Total 4 raw suppliers

Chemical Property of 3-(1H-benzimidazol-1-yl)propanenitrile

Chemical Property:

Vapor Pressure:5.27E-06mmHg at 25°C
Refractive Index:1.622
Boiling Point:380.9°Cat760mmHg
Flash Point:184.2°C
PSA：41.61000
Density:1.15g/cm³
LogP:1.94998
XLogP3:1.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:171.079647300
Heavy Atom Count:13
Complexity:218

Purity/Quality:

99% ^*data from raw suppliers

3-(1H-benzimidazol-1-yl)propanenitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C2C(=C1)N=CN2CCC#N

Technology Process of 3-(1H-benzimidazol-1-yl)propanenitrile

There total 3 articles about 3-(1H-benzimidazol-1-yl)propanenitrile 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: 96.8%

: 51-17-2,79351-71-6
benzoimidazole

: 107-13-1,25014-41-9
acrylonitrile

: 4414-84-0
3-(1H-benzo[d]imidazol-1-yl)propanenitrile

Guidance literature:: In neat (no solvent, gas phase); at 40 ℃; for 2h; Microwave irradiation; Molecular sieve; Green chemistry;
DOI:10.1016/j.jics.2022.100411

Reference yield:

: 51-17-2,79351-71-6
benzoimidazole

: 542-76-7
3-Chloropropionitrile

: 4414-84-0
3-(1H-benzo[d]imidazol-1-yl)propanenitrile

Guidance literature:: With tetra-(n-butyl)ammonium iodide; potassium carbonate; triethylamine; In acetonitrile; Reflux;
DOI:10.5935/0103-5053.20160138