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2963-65-7 | 1H-Benzimidazole, 6-methyl-2-phenyl-
CAS No: 2963-65-7 Catalog No: AG002YY9 MDL No:
Product Description
Catalog Number:
AG002YY9
Chemical Name:
1H-Benzimidazole, 6-methyl-2-phenyl-
CAS Number:
2963-65-7
Molecular Formula:
C14H12N2
Molecular Weight:
208.2585
IUPAC Name:
6-methyl-2-phenyl-1H-benzimidazole
InChI:
InChI=1S/C14H12N2/c1-10-7-8-12-13(9-10)16-14(15-12)11-5-3-2-4-6-11/h2-9H,1H3,(H,15,16)
InChI Key:
TUTVDOPAKOUNQV-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)[nH]c(n2)c1ccccc1
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.1g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.264g/mol
Monoisotopic Mass:
208.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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