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14434-10-7 | Benzenamine, 2,4-dinitro-N-(2-nitrophenyl)-
CAS No: 14434-10-7 Catalog No: AG001JDB MDL No:
Product Description
Catalog Number:
AG001JDB
Chemical Name:
Benzenamine, 2,4-dinitro-N-(2-nitrophenyl)-
CAS Number:
14434-10-7
Molecular Formula:
C12H8N4O6
Molecular Weight:
304.2151
IUPAC Name:
2,4-dinitro-N-(2-nitrophenyl)aniline
InChI:
InChI=1S/C12H8N4O6/c17-14(18)8-5-6-10(12(7-8)16(21)22)13-9-3-1-2-4-11(9)15(19)20/h1-7,13H
InChI Key:
RHTGPRLQFAYVBM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1Nc1ccccc1[N+](=O)[O-])[N+](=O)[O-]
EC Number:
238-406-7
NSC Number:
406142
Properties
Complexity:
442
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.044g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.218g/mol
Monoisotopic Mass:
304.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
150A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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