Cas no 252954-49-7 (Ethanol,2-[(6-amino-5-nitro-2-pyridinyl)amino]-)
![Ethanol,2-[(6-amino-5-nitro-2-pyridinyl)amino]- structure](https://ossimg.kuujia.com/scimg/253000/252954-49-7x500.png)
252954-49-7 structure
Product Name:Ethanol,2-[(6-amino-5-nitro-2-pyridinyl)amino]-
CAS No:252954-49-7
MF:C7H10N4O3
MW:198.179300785065
CID:246587
Update Time:2024-01-26
Ethanol,2-[(6-amino-5-nitro-2-pyridinyl)amino]- Chemical and Physical Properties
Names and Identifiers
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- Ethanol,2-[(6-amino-5-nitro-2-pyridinyl)amino]-
- Ethanol, 2-[(6-amino-5-nitro-2-pyridinyl)amino]- (9CI)
- Ethanol, 2-[(6-amino-5-nitro-2-pyridinyl)amino]-
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- Inchi： 1S/C7H10N4O3/c8-7-5(11(13)14)1-2-6(10-7)9-3-4-12/h1-2,12H,3-4H2,(H3,8,9,10)
- InChI Key： SGXWWLPADNJGFI-UHFFFAOYSA-N
- SMILES： C(O)CNC1=NC(N)=C([N+]([O-])=O)C=C1
Computed Properties
- Exact Mass: 198.075
- Monoisotopic Mass: 198.075
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 196
- 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: 117A^2
Ethanol,2-[(6-amino-5-nitro-2-pyridinyl)amino]- Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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