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Home > Imidazoles > 403643-09-4
403643-09-4 | 4-(5,6-DIMETHYL-1H-BENZIMIDAZOL-2-YL)BENZONITRILE
CAS No: 403643-09-4 Catalog No: AG00CVCY MDL No:
Product Description
Catalog Number:
AG00CVCY
Chemical Name:
4-(5,6-DIMETHYL-1H-BENZIMIDAZOL-2-YL)BENZONITRILE
CAS Number:
403643-09-4
IUPAC Name:
4-(5,6-dimethyl-1H-benzimidazol-2-yl)benzonitrile
InChI:
InChI=1S/C16H13N3/c1-10-7-14-15(8-11(10)2)19-16(18-14)13-5-3-12(9-17)4-6-13/h3-8H,1-2H3,(H,18,19)
InChI Key:
JUNYAQMKXZTNQE-UHFFFAOYSA-N
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.111g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.301g/mol
Monoisotopic Mass:
247.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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