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91467-48-0 | 2-Hydrazino-5-nitro-1H-1,3-benzimidazole
CAS No: 91467-48-0 Catalog No: AG006A9Y MDL No:MFCD08276961
Product Description
Catalog Number:
AG006A9Y
Chemical Name:
2-Hydrazino-5-nitro-1H-1,3-benzimidazole
CAS Number:
91467-48-0
Molecular Formula:
C7H7N5O2
Molecular Weight:
193.1628
MDL Number:
MFCD08276961
IUPAC Name:
(6-nitro-1H-benzimidazol-2-yl)hydrazine
InChI:
InChI=1S/C7H7N5O2/c8-11-7-9-5-2-1-4(12(13)14)3-6(5)10-7/h1-3H,8H2,(H2,9,10,11)
InChI Key:
CXSMPTOEEIBHEG-UHFFFAOYSA-N
SMILES:
NNc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.06g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
193.166g/mol
Monoisotopic Mass:
193.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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