2-[(2-Chlorophenyl)sulfanyl]-5-nitropyridine
Basic information
- CAS
353277-31-3- Standard SMILES
O=[N+]([O-])c1ccc(Sc2ccccc2Cl)nc1- InChIKey
MPSSZZXHIKTHQT-UHFFFAOYSA-N- Molecular formula
- C11H7ClN2O2S
- Average molar mass
- 266.7 g/mol
- Monoisotopic mass
- 265.9916763
Names & identifiers
- Preferred name
- 2-[(2-Chlorophenyl)sulfanyl]-5-nitropyridine
- IUPAC
- 2-(2-chlorophenyl)sulfanyl-5-nitropyridine
- English name
- 2-[(2-chlorophenyl)sulfanyl]-5-nitropyridine
- Molecular formula
- C11H7ClN2O2S
- Molecular weight
- 266.70348
Names & synonyms
2-[(2-chlorophenyl)sulfanyl]-5-nitropyridine353277-31-32-[(2-Chlorophenyl)thio]-5-nitropyridineMLS0005392062-(2-chlorophenyl)sulfanyl-5-nitropyridineCHEMBL1432364SCHEMBL25199024DTXSID801277583HMS2391H20AKOS008858847SMR000164031AJ-333/09215064
Database identifiers
- CAS
353277-31-3- PubChem CID
- 901283
- DTXSID
DTXSID801277583- ChEMBL
CHEMBL1432364
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…