Cas no 53014-37-2 (Benzenamine,tetranitro-)
Benzenamine,tetranitro- structure
Product Name:Benzenamine,tetranitro-
CAS No:53014-37-2
MF:C6H3N5O8
MW:273.116720438004
CID:374050
PubChem ID:40601
Update Time:2025-04-19
Benzenamine,tetranitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine,tetranitro-
- 2,3,5,6-tetranitroaniline
- Tetranitroaniline [UN0207] [Explosive 1.1D]
- UN0207
- 53014-37-2
- EINECS 258-295-9
- DTXSID70967510
- 2,3,4,6-Tetranitroanilin
- Benzenamine, tetranitro-
- SCHEMBL3366894
- Tetranitroaniline [UN0207] [Explosive 1.1D]
-
- Inchi: 1S/C6H3N5O8/c7-4-5(10(16)17)2(8(12)13)1-3(9(14)15)6(4)11(18)19/h1H,7H2
- InChI Key: NXEMFHROMKRKEG-UHFFFAOYSA-N
- SMILES: [O-][N+](C1C(=CC(=C(C=1N)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 272.99819
- Monoisotopic Mass: 272.998
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 19
- Rotatable Bond Count: 0
- Complexity: 379
- 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
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 1.1
- Topological Polar Surface Area: 209A^2
Experimental Properties
- Density: 1.963
- Boiling Point: 569.5°Cat760mmHg
- Flash Point: 298.2°C
- Refractive Index: 1.75
- PSA: 175.8
Benzenamine,tetranitro- Related Literature
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
-
R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
-
José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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