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90463-26-6 | 1H-Benzimidazole, 6-phenyl-
CAS No: 90463-26-6 Catalog No: AG006Q1X MDL No:
Product Description
Catalog Number:
AG006Q1X
Chemical Name:
1H-Benzimidazole, 6-phenyl-
CAS Number:
90463-26-6
Molecular Formula:
C13H10N2
Molecular Weight:
194.2319
IUPAC Name:
6-phenyl-1H-benzimidazole
InChI:
InChI=1S/C13H10N2/c1-2-4-10(5-3-1)11-6-7-12-13(8-11)15-9-14-12/h1-9H,(H,14,15)
InChI Key:
FRENWXHQIOTWRD-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1ccc2c(c1)[nH]cn2
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.084g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.237g/mol
Monoisotopic Mass:
194.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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