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Home > Nitro Compounds > 7071-14-9
7071-14-9 | Acetonitrile, [(4-nitrophenyl)azo][(4-nitrophenyl)hydrazono]-
CAS No: 7071-14-9 Catalog No: AG005SS8 MDL No:
Product Description
Catalog Number:
AG005SS8
Chemical Name:
Acetonitrile, [(4-nitrophenyl)azo][(4-nitrophenyl)hydrazono]-
CAS Number:
7071-14-9
Molecular Formula:
C14H9N7O4
Molecular Weight:
339.2658
IUPAC Name:
1-cyano-N'-(4-nitroanilino)-N-(4-nitrophenyl)iminomethanimidamide
InChI:
InChI=1S/C14H9N7O4/c15-9-14(18-16-10-1-5-12(6-2-10)20(22)23)19-17-11-3-7-13(8-4-11)21(24)25/h1-8,16H
InChI Key:
YDJYYCLNFHCGQE-UHFFFAOYSA-N
SMILES:
N#CC(=NNc1ccc(cc1)[N+](=O)[O-])N=Nc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
585
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.072g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
339.271g/mol
Monoisotopic Mass:
339.072g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
165A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.4
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