Cas no 702642-25-9 (Benzenamine,4-ethyl-3,5-dinitro-)
702642-25-9 structure
Product Name:Benzenamine,4-ethyl-3,5-dinitro-
CAS No:702642-25-9
MF:C8H9N3O4
MW:211.174761533737
CID:557365
PubChem ID:45095005
Update Time:2025-04-19
Benzenamine,4-ethyl-3,5-dinitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine,4-ethyl-3,5-dinitro-
- Benzenamine, 4-ethyl-3,5-dinitro- (9CI)
- 4-ethyl-3,5-dinitroaniline
- DTXSID10667345
- 702642-25-9
- Benzenamine,4-ethyl-3,5-dinitro-(9ci)
-
- Inchi： 1S/C8H9N3O4/c1-2-6-7(10(12)13)3-5(9)4-8(6)11(14)15/h3-4H,2,9H2,1H3
- InChI Key： BNTIGSBCIDBMOK-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C(C=C(C=1CC)[N+](=O)[O-])N)=O
Computed Properties
- Exact Mass: 211.059
- Monoisotopic Mass: 211.059
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 236
- 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
- Topological Polar Surface Area: 118A^2
- XLogP3: 1.7
Benzenamine,4-ethyl-3,5-dinitro- Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
702642-25-9 (Benzenamine,4-ethyl-3,5-dinitro-) Related Products
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