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24547-45-3 | 1H-Benzimidazole, 2-chloro-1-phenyl-
CAS No: 24547-45-3 Catalog No: AG002OI9 MDL No:
Product Description
Catalog Number:
AG002OI9
Chemical Name:
1H-Benzimidazole, 2-chloro-1-phenyl-
CAS Number:
24547-45-3
Molecular Formula:
C13H9ClN2
Molecular Weight:
228.6770
IUPAC Name:
2-chloro-1-phenylbenzimidazole
InChI:
InChI=1S/C13H9ClN2/c14-13-15-11-8-4-5-9-12(11)16(13)10-6-2-1-3-7-10/h1-9H
InChI Key:
JZMUUDCDJJOJSW-UHFFFAOYSA-N
SMILES:
Clc1nc2c(n1c1ccccc1)cccc2
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.045g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.679g/mol
Monoisotopic Mass:
228.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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