Cas no 15979-87-0 (Benzenamine,3-nitro-N-(4-nitrophenyl)-)
15979-87-0 structure
Product Name:Benzenamine,3-nitro-N-(4-nitrophenyl)-
CAS No:15979-87-0
MF:C12H9N3O4
MW:259.217562437058
CID:176048
PubChem ID:27595
Update Time:2025-04-19
Benzenamine,3-nitro-N-(4-nitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine,3-nitro-N-(4-nitrophenyl)-
- 3-NITRO-N-(4-NITROPHENYL)BENZENAMINE
- 3-nitro-N-(4-nitrophenyl)aniline
- 15979-87-0
- AKOS000286161
- DTXSID30166729
-
- Inchi： 1S/C12H9N3O4/c16-14(17)11-6-4-9(5-7-11)13-10-2-1-3-12(8-10)15(18)19/h1-8,13H
- InChI Key： GBRRZYZALUGPSM-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC=CC(=C1)NC1C=CC(=CC=1)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 259.05937
- Monoisotopic Mass: 259.059
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 331
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.6
- Topological Polar Surface Area: 104A^2
Experimental Properties
- Density: 1.446
- Boiling Point: 440.1°Cat760mmHg
- Flash Point: 219.9°C
- Refractive Index: 1.693
- PSA: 98.31
Benzenamine,3-nitro-N-(4-nitrophenyl)- Related Literature
-
Daniel H. O'Donovan,Brendan Kelly,Elena Diez-Cecilia,Martin Kitson,Isabel Rozas New J. Chem. 2013 37 2408
15979-87-0 (Benzenamine,3-nitro-N-(4-nitrophenyl)-) Related Products
- 4316-57-8(4-Nitrophenyl Diphenylamine)
- 1100-10-3(Bis-(4-nitrophenyl)phenylamine)
- 100-15-2(N-Methyl-4-nitroaniline)
- 836-30-6((4-Nitrophenyl)phenylamine)
- 1821-27-8(Bis-(4-nitrophenyl)amine)
- 20440-93-1(Tris(p-nitrophenyl)amine)
- 4531-79-7(3-nitro-N-phenylaniline)
- 619-26-1(n-Methyl-3-nitroaniline)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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