Cas no 19404-40-1 (N-Methyl-3,5-dinitropyridin-2-amine)
19404-40-1 structure
Product Name:N-Methyl-3,5-dinitropyridin-2-amine
CAS No:19404-40-1
MF:C6H6N4O4
MW:198.13624048233
CID:123553
PubChem ID:3108280
Update Time:2025-04-18
N-Methyl-3,5-dinitropyridin-2-amine Chemical and Physical Properties
Names and Identifiers
-
- N-Methyl-3,5-dinitropyridin-2-amine
- 2-Pyridinamine,N-methyl-3,5-dinitro-
- (3,5-Dinitro-pyridin-2-yl)-methyl-amine
- 1-(3,5-dinitropyridin-2-yl)methanamine
- 2-Pyridinamine,N-methyl-3,5-dinitro-(9CI)
- DTXSID70389319
- FT-0755633
- SCHEMBL6634074
- AKOS000539112
- A4271
- 19404-40-1
-
- MDL： MFCD00754472
- Inchi： 1S/C6H6N4O4/c1-7-6-5(10(13)14)2-4(3-8-6)9(11)12/h2-3H,1H3,(H,7,8)
- InChI Key： YWRUAYGJVVNKFK-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC(=CN=C1NC)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 198.03898
- Monoisotopic Mass: 198.039
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 235
- 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: 1.4
- Topological Polar Surface Area: 117?2
Experimental Properties
- Density: 1.568
- Boiling Point: 348°C at 760 mmHg
- Flash Point: 164.3°C
- Refractive Index: 1.646
- PSA: 125.19
- LogP: 2.05910
N-Methyl-3,5-dinitropyridin-2-amine Related Literature
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
-
Eunkyung Choi,Minjoo Ryu,Haeri Lee,Ok-Sang Jung Dalton Trans., 2017,46, 4595-4601
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
19404-40-1 (N-Methyl-3,5-dinitropyridin-2-amine) Related Products
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