(5,6-Dimethyl-1H-benzimidazol-1-YL)acetonitrile

Base Information

• Chemical Name: (5,6-Dimethyl-1H-benzimidazol-1-YL)acetonitrile
• CAS No.: 167980-30-5
• Molecular Formula: C11H11 N3
• Molecular Weight: 185.23
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID90588660
• Wikidata: Q82481478
• Mol file: 167980-30-5.mol

Synonyms:167980-30-5;2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)acetonitrile;(5,6-DIMETHYL-1H-BENZIMIDAZOL-1-YL)ACETONITRILE;1H-Benzimidazole-1-acetonitrile,5,6-dimethyl-(9CI);2-(5,6-dimethylbenzimidazol-1-yl)acetonitrile;2-(5,6-Dimethyl-1H-benzo[d]imidazol-1-yl)acetonitrile;SCHEMBL19848361;DTXSID90588660;MFCD09880357;STL300431;AKOS000178712;MCULE-7149894131;BS-37411;EN300-44218;J-010418;F2101-0134;Z149288250;2-(5,6-DIMETHYL-1,3-BENZODIAZOL-1-YL)ACETONITRILE

Chemical Property of (5,6-Dimethyl-1H-benzimidazol-1-YL)acetonitrile

Chemical Property:

• Vapor Pressure: 4.71E-06mmHg at 25°C
• Refractive Index: 1.611
• Boiling Point: 382.5°C at 760 mmHg
• Flash Point: 185.1°C
• PSA: 41.61000
• Density: 1.13g/cm³
• LogP: 2.17668
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 185.095297364
• Heavy Atom Count: 14
• Complexity: 255

Purity/Quality:

97% ^*data from raw suppliers

2-(5,6-dimethyl-1H-1,3-benzodiazol-1-yl)acetonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1C)N(C=N2)CC#N