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24752-30-5 | 1H-Benzimidazol-2-amine, N-(4-chlorophenyl)-
CAS No: 24752-30-5 Catalog No: AG002PBE MDL No:
Product Description
Catalog Number:
AG002PBE
Chemical Name:
1H-Benzimidazol-2-amine, N-(4-chlorophenyl)-
CAS Number:
24752-30-5
Molecular Formula:
C13H10ClN3
Molecular Weight:
243.6916
IUPAC Name:
N-(4-chlorophenyl)-1H-benzimidazol-2-amine
InChI:
InChI=1S/C13H10ClN3/c14-9-5-7-10(8-6-9)15-13-16-11-3-1-2-4-12(11)17-13/h1-8H,(H2,15,16,17)
InChI Key:
ATZIHMHTBDVWPP-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Nc1nc2c([nH]1)cccc2
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.694g/mol
Monoisotopic Mass:
243.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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