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824394-97-0 | 1H-Benzimidazole, 2-[2-(2-pyridinyl)phenyl]-
CAS No: 824394-97-0 Catalog No: AG008JVK MDL No:
Product Description
Catalog Number:
AG008JVK
Chemical Name:
1H-Benzimidazole, 2-[2-(2-pyridinyl)phenyl]-
CAS Number:
824394-97-0
Molecular Formula:
C18H13N3
Molecular Weight:
271.3159
IUPAC Name:
2-(2-pyridin-2-ylphenyl)-1H-benzimidazole
InChI:
InChI=1S/C18H13N3/c1-2-8-14(13(7-1)15-9-5-6-12-19-15)18-20-16-10-3-4-11-17(16)21-18/h1-12H,(H,20,21)
InChI Key:
MLPRKUDFGMXGLT-UHFFFAOYSA-N
SMILES:
c1ccc(nc1)c1ccccc1c1nc2c([nH]1)cccc2
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.111g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.323g/mol
Monoisotopic Mass:
271.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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