Cas no 345629-42-7 (1,2-Ethanediamine,N-methyl-N-(5-nitro-2-pyridinyl)-(9CI))
345629-42-7 structure
Product Name:1,2-Ethanediamine,N-methyl-N-(5-nitro-2-pyridinyl)-(9CI)
CAS No:345629-42-7
MF:C8H12N4O2
MW:196.206480979919
CID:919333
PubChem ID:21307321
Update Time:2025-04-19
1,2-Ethanediamine,N-methyl-N-(5-nitro-2-pyridinyl)-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Ethanediamine,N-methyl-N-(5-nitro-2-pyridinyl)-(9CI)
- N-methyl-N'-(5-nitropyridin-2-yl)ethane-1,2-diamine
- AKOS011953331
- DTXSID20612189
- N~1~-Methyl-N~2~-(5-nitropyridin-2-yl)ethane-1,2-diamine
- 345629-42-7
- SCHEMBL13649701
-
- Inchi： 1S/C8H12N4O2/c1-9-4-5-10-8-3-2-7(6-11-8)12(13)14/h2-3,6,9H,4-5H2,1H3,(H,10,11)
- InChI Key： NXONIPCBEYLWBD-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CN=C(C=C1)NCCNC)=O
Computed Properties
- Exact Mass: 196.09602564g/mol
- Monoisotopic Mass: 196.09602564g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 183
- 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: 0.6
- Topological Polar Surface Area: 82.8?2
1,2-Ethanediamine,N-methyl-N-(5-nitro-2-pyridinyl)-(9CI) Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
345629-42-7 (1,2-Ethanediamine,N-methyl-N-(5-nitro-2-pyridinyl)-(9CI)) Related Products
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