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10173-73-6 | 1H-Benzimidazole, 5,6-dichloro-2-(2-nitrophenyl)-
CAS No: 10173-73-6 Catalog No: AG0005CP MDL No:
Product Description
Catalog Number:
AG0005CP
Chemical Name:
1H-Benzimidazole, 5,6-dichloro-2-(2-nitrophenyl)-
CAS Number:
10173-73-6
Molecular Formula:
C13H7Cl2N3O2
Molecular Weight:
308.1196
IUPAC Name:
5,6-dichloro-2-(2-nitrophenyl)-1H-benzimidazole
InChI:
InChI=1S/C13H7Cl2N3O2/c14-8-5-10-11(6-9(8)15)17-13(16-10)7-3-1-2-4-12(7)18(19)20/h1-6H,(H,16,17)
InChI Key:
PVQSGCKEIAUOLM-UHFFFAOYSA-N
SMILES:
Clc1cc2[nH]c(nc2cc1Cl)c1ccccc1[N+](=O)[O-]
NSC Number:
128746
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.992g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.118g/mol
Monoisotopic Mass:
306.992g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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