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14225-77-5 | 1H-Benzimidazole, 2-(2-chlorophenyl)-5,6-dimethyl-
CAS No: 14225-77-5 Catalog No: AG001I1W MDL No:MFCD11912412
Product Description
Catalog Number:
AG001I1W
Chemical Name:
1H-Benzimidazole, 2-(2-chlorophenyl)-5,6-dimethyl-
CAS Number:
14225-77-5
Molecular Formula:
C15H13ClN2
Molecular Weight:
256.7301
MDL Number:
MFCD11912412
IUPAC Name:
2-(2-chlorophenyl)-5,6-dimethyl-1H-benzimidazole
InChI:
InChI=1S/C15H13ClN2/c1-9-7-13-14(8-10(9)2)18-15(17-13)11-5-3-4-6-12(11)16/h3-8H,1-2H3,(H,17,18)
InChI Key:
OIBAGMVKMXOVKD-UHFFFAOYSA-N
SMILES:
Clc1ccccc1c1[nH]c2c(n1)cc(c(c2)C)C
NSC Number:
128756
Properties
Complexity:
296
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.077g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.733g/mol
Monoisotopic Mass:
256.077g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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