Cas no 244261-31-2 (2-Pyrazinamine,5-nitro-)
2-Pyrazinamine,5-nitro- structure
Product Name:2-Pyrazinamine,5-nitro-
CAS No:244261-31-2
MF:C4H4N4O2
MW:140.100159645081
CID:245868
PubChem ID:45116725
Update Time:2025-04-19
2-Pyrazinamine,5-nitro- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pyrazinamine,5-nitro-
- Pyrazinamine,5-nitro- (9CI)
- 5-nitro-2-Pyrazinamine
- 5-nitropyrazin-2-amine
- 244261-31-2
- FT-0744183
-
- Inchi： 1S/C4H4N4O2/c5-3-1-7-4(2-6-3)8(9)10/h1-2H,(H2,5,6)
- InChI Key： IEYQCJINVCBCQG-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=NC(=CN=1)N)=O
Computed Properties
- Exact Mass: 140.033
- Monoisotopic Mass: 140.033
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 134
- 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: 97.6A^2
- XLogP3: -0.4
2-Pyrazinamine,5-nitro- Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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