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Basic information
- CAS
6137-69-5- Standard SMILES
COc1ccccc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1- InChIKey
WSNWIRYJZRXIPG-UHFFFAOYSA-N- Molecular formula
- C13H11ClN2O5S
- Average molar mass
- 342.76 g/mol
- Monoisotopic mass
- 342.0077203
Names & identifiers
- Preferred name
- 4-chloro-N-(2-methoxyphenyl)-3-nitrobenzenesulfonamide
- IUPAC
- 4-chloro-N-(2-methoxyphenyl)-3-nitrobenzenesulfonamide
Names & synonyms
4-chloro-N-(2-methoxyphenyl)-3-nitrobenzenesulfonamide6137-69-5CBMicro_011383SCHEMBL3611184DTXSID20387360WSNWIRYJZRXIPG-UHFFFAOYSA-NSMSF0014877CB14505BIM-0011428.P001SR-01000228840SR-01000228840-14-Chloro-N-(2-methoxyphenyl)-3nitrobenzenesulfonamide
Show more names
4-Chloro-N-(2-methoxy-phenyl)-3-nitrobenzenesulfonamide4-Chloro-N-(2-methoxyphenyl)-3-nitrobenzene-1-sulfonamide
Database identifiers
- CAS
6137-69-5- PubChem CID
- 2887683
- DTXSID
DTXSID20387360
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 490
Related reactions
17 records
Compound notes
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