Cas no 741250-63-5 (Benzenamine,2-ethyl-3,5-dinitro-)
741250-63-5 structure
Product Name:Benzenamine,2-ethyl-3,5-dinitro-
CAS No:741250-63-5
MF:C8H9N3O4
MW:211.174761533737
CID:560184
PubChem ID:45095001
Update Time:2025-04-19
Benzenamine,2-ethyl-3,5-dinitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine,2-ethyl-3,5-dinitro-
- Benzenamine, 2-ethyl-3,5-dinitro- (9CI)
- 2-ethyl-3,5-dinitroaniline
- DTXSID50667344
- 741250-63-5
-
- Inchi： 1S/C8H9N3O4/c1-2-6-7(9)3-5(10(12)13)4-8(6)11(14)15/h3-4H,2,9H2,1H3
- InChI Key： BGNDEPVCCNWEMM-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C(C=C(C=1CC)N)[N+](=O)[O-])=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: 260
- 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,2-ethyl-3,5-dinitro- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
741250-63-5 (Benzenamine,2-ethyl-3,5-dinitro-) Related Products
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