2-(4-Methyl-2-nitro-phenylsulfanyl)-pyridine
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Basic information
- Standard SMILES
Cc1ccc(Sc2ccccn2)c([N+](=O)[O-])c1- InChIKey
ZJGTYGVGYDDPEL-UHFFFAOYSA-N- Molecular formula
- C12H10N2O2S
- Average molar mass
- 246.29 g/mol
Names & identifiers
- Preferred name
- 2-(4-Methyl-2-nitro-phenylsulfanyl)-pyridine
- IUPAC
- 2-(4-methyl-2-nitrophenyl)sulfanylpyridine
Names & synonyms
SCHEMBL2961974ZJGTYGVGYDDPEL-UHFFFAOYSA-N2-(4-Methyl-2-nitro-phenylsulfanyl)-pyridine
Database identifiers
- PubChem CID
- 68458445
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 270
Related reactions
3 records
Compound notes
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