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Home > Imidazoles > 192879-70-2
192879-70-2 | 1H-Benzimidazole, 2-(3,4-dinitrophenyl)-6-phenyl-
CAS No: 192879-70-2 Catalog No: AG002GEW MDL No:
Product Description
Catalog Number:
AG002GEW
Chemical Name:
1H-Benzimidazole, 2-(3,4-dinitrophenyl)-6-phenyl-
CAS Number:
192879-70-2
Molecular Formula:
C19H12N4O4
Molecular Weight:
360.3230
IUPAC Name:
2-(3,4-dinitrophenyl)-6-phenyl-1H-benzimidazole
InChI:
InChI=1S/C19H12N4O4/c24-22(25)17-9-7-14(11-18(17)23(26)27)19-20-15-8-6-13(10-16(15)21-19)12-4-2-1-3-5-12/h1-11H,(H,20,21)
InChI Key:
AIOZGPOUTXQDQZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1[N+](=O)[O-])c1nc2c([nH]1)cc(cc2)c1ccccc1
Properties
Complexity:
557
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.086g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
360.329g/mol
Monoisotopic Mass:
360.086g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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