Cas no 82650-28-0 (3-nitro-2-pyridyl disulfide)
3-nitro-2-pyridyl disulfide structure
Product Name:3-nitro-2-pyridyl disulfide
CAS No:82650-28-0
MF:C6H6N2O2S2
MW:202.254038333893
CID:988051
PubChem ID:134060
Update Time:2025-04-20
3-nitro-2-pyridyl disulfide Chemical and Physical Properties
Names and Identifiers
-
- 3-nitro-2-pyridyl disulfide
- Npyssm
- 2-(methyldisulfanyl)-3-nitropyridine
- SCHEMBL13596619
- DTXSID701002828
- Pyridine, 2-(methyldithio)-3-nitro-
- 82650-28-0
-
- Inchi： 1S/C6H6N2O2S2/c1-11-12-6-5(8(9)10)3-2-4-7-6/h2-4H,1H3
- InChI Key： JJJBMWFBWHJKTG-UHFFFAOYSA-N
- SMILES： S(C1C(=CC=CN=1)[N+](=O)[O-])SC
Computed Properties
- Exact Mass: 201.98706979g/mol
- Monoisotopic Mass: 201.98706979g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 162
- 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: 1.6
- Topological Polar Surface Area: 109?2
3-nitro-2-pyridyl disulfide Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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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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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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