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13916-77-3 | Benzenamine, 4-nitro-N-(4-nitrophenyl)-N-nitroso-
CAS No: 13916-77-3 Catalog No: AG007ZGZ MDL No:
Product Description
Catalog Number:
AG007ZGZ
Chemical Name:
Benzenamine, 4-nitro-N-(4-nitrophenyl)-N-nitroso-
CAS Number:
13916-77-3
Molecular Formula:
C12H8N4O5
Molecular Weight:
288.2157
IUPAC Name:
N,N-bis(4-nitrophenyl)nitrous amide
InChI:
InChI=1S/C12H8N4O5/c17-13-14(9-1-5-11(6-2-9)15(18)19)10-3-7-12(8-4-10)16(20)21/h1-8H
InChI Key:
DMTCHVZPELIQPN-UHFFFAOYSA-N
SMILES:
O=NN(c1ccc(cc1)[N+](=O)[O-])c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.049g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
288.219g/mol
Monoisotopic Mass:
288.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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