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Benzenamine,4-Nitro-n-(4-nitrophenyl)-

Catalog Number
ACM1821278
CAS Number
1821-27-8
Product Name
Benzenamine,4-Nitro-n-(4-nitrophenyl)-
Structure
Category
Electroluminescence Materials
IUPAC Name
4-nitro-N-(4-nitrophenyl)aniline
Molecular Weight
259.22g/mol
Molecular Formula
C12H9N3O4
Canonical SMILES
C1=CC(=CC=C1NC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C12H9N3O4/c16-14(17)11-5-1-9(2-6-11)13-10-3-7-12(8-4-10)15(18)19/h1-8,13H
InChI Key
MTWHRQTUBOTQTE-UHFFFAOYSA-N
Complexity
291
Covalently-Bonded Unit Count
1
EC Number
217-343-9
Exact Mass
259.059306g/mol
Formal Charge
0
Heavy Atom Count
19
Monoisotopic Mass
259.059306g/mol
NSC Number
36659
Rotatable Bond Count
2
XLogP3
3.6
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