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Home > Imidazoles > 884069-38-9
884069-38-9 | 4-(2-METHYL-1H-BENZIMIDAZOL-1-YL)BENZONITRILE
CAS No: 884069-38-9 Catalog No: AG01DWS9 MDL No:MFCD10001519
Product Description
Catalog Number:
AG01DWS9
Chemical Name:
4-(2-METHYL-1H-BENZIMIDAZOL-1-YL)BENZONITRILE
CAS Number:
884069-38-9
Molecular Formula:
C15H11N3
Molecular Weight:
233.2679
MDL Number:
MFCD10001519
IUPAC Name:
4-(2-methylbenzimidazol-1-yl)benzonitrile
InChI:
InChI=1S/C15H11N3/c1-11-17-14-4-2-3-5-15(14)18(11)13-8-6-12(10-16)7-9-13/h2-9H,1H3
InChI Key:
ZXRGQOWZKLFSQY-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)n1c(C)nc2c1cccc2
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.274g/mol
Monoisotopic Mass:
233.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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