Basic information
- CAS
167156-18-5- Standard SMILES
CN(c1ccccc1)S(=O)(=O)c1ccc(I)cc1- InChIKey
ABHNPYBZRCZVTN-UHFFFAOYSA-N- Molecular formula
- C13H12INO2S
- Average molar mass
- 373.21 g/mol
- Monoisotopic mass
- 372.96335
Names & identifiers
- Preferred name
- 4-iodo-N-methyl-N-phenylbenzenesulfonamide
- IUPAC
- 4-iodo-N-methyl-N-phenylbenzenesulfonamide
- English name
- Benzenesulfonamide, 4-iodo-N-methyl-N-phenyl-
- Molecular formula
- C13H12INO2S
- Molecular weight
- 373.21
Names & synonyms
4-iodo-N-methyl-N-phenylbenzenesulfonamide167156-18-5SCHEMBL7822429DTXSID601268253HMS1600C114-Iodo-N-methyl-N-phenylbenzene-1-sulfonamideBenzenesulfonamide, 4-iodo-N-methyl-N-phenyl-
Database identifiers
- CAS
167156-18-5- PubChem CID
- 2980337
- DTXSID
DTXSID601268253
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 352
Physicochemical properties
- Boiling point
- 434.376 · 434.376±47.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.703 · 1.703±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
Chemistry & industry
Suppliers1 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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