Cas no 1095539-49-3 (2-methyl-5-(2-nitroethenyl)-Pyridine)
1095539-49-3 structure
Product Name:2-methyl-5-(2-nitroethenyl)-Pyridine
CAS No:1095539-49-3
MF:C8H8N2O2
MW:164.161321640015
CID:1098629
PubChem ID:91090827
Update Time:2025-04-20
2-methyl-5-(2-nitroethenyl)-Pyridine Chemical and Physical Properties
Names and Identifiers
-
- 2-methyl-5-(2-nitroethenyl)-Pyridine
- 1095539-49-3
- SCHEMBL21748733
- 2-methyl-5-[(E)-2-nitroethenyl]pyridine, E
-
- Inchi： 1S/C8H8N2O2/c1-7-2-3-8(6-9-7)4-5-10(11)12/h2-6H,1H3
- InChI Key： SHFOVTPOZDIGET-UHFFFAOYSA-N
- SMILES： [O-][N+](C=CC1=CN=C(C)C=C1)=O
Computed Properties
- Exact Mass: 164.059
- Monoisotopic Mass: 164.059
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 186
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 58.7A^2
- XLogP3: 1.5
2-methyl-5-(2-nitroethenyl)-Pyridine Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
1095539-49-3 (2-methyl-5-(2-nitroethenyl)-Pyridine) Related Products
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