Home Nitriles (1-Methyl-1H-benzoimidazol-2-yl)acetonitrile

(1-Methyl-1H-benzoimidazol-2-yl)acetonitrile

CAS No.:
2735-62-8
Catalog Number:
AG00BFFM
Molecular Formula:
C10H9N3
Molecular Weight:
171.1986
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Product Description
Catalog Number:
AG00BFFM
Chemical Name:
(1-Methyl-1H-benzoimidazol-2-yl)acetonitrile
CAS Number:
2735-62-8
Molecular Formula:
C10H9N3
Molecular Weight:
171.1986
MDL Number:
MFCD00227239
IUPAC Name:
2-(1-methylbenzimidazol-2-yl)acetonitrile
InChI:
InChI=1S/C10H9N3/c1-13-9-5-3-2-4-8(9)12-10(13)6-7-11/h2-5H,6H2,1H3
InChI Key:
DYWFJPNNNWXOAK-UHFFFAOYSA-N
SMILES:
N#CCc1nc2c(n1C)cccc2
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.08g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.203g/mol
Monoisotopic Mass:
171.08g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties