Basic information
- CAS
330467-29-3- Standard SMILES
COc1ccccc1CNS(=O)(=O)c1ccc(F)cc1- InChIKey
RRBXLRDDBSJDID-UHFFFAOYSA-N- Molecular formula
- C14H14FNO3S
- Average molar mass
- 295.33 g/mol
- Monoisotopic mass
- 295.06784264
Names & identifiers
- Preferred name
- 4-fluoro-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
- IUPAC
- 4-fluoro-N-[(2-methoxyphenyl)methyl]benzenesulfonamide
- English name
- 4-fluoro-N-{[2-(methyloxy)phenyl]methyl}benzenesulfonamide
- Molecular formula
- C14H14FNO3S
- Molecular weight
- 295.33
Names & synonyms
4-fluoro-N-[(2-methoxyphenyl)methyl]benzenesulfonamide330467-29-34-fluoro-N-(2-methoxybenzyl)benzenesulfonamide4-fluoro-N-[(2-methoxyphenyl)methyl]benzene-1-sulfonamideOprea1_421307STK068587AKOS000390171ST042507AG-690/11634690SR-01000478014SR-01000478014-1[(4-fluorophenyl)sulfonyl][(2-methoxyphenyl)methyl]amine
Show more names
Benzenesulfonamide, 4-fluoro-N-[(2-methoxyphenyl)methyl]-
4-fluoro-N-{[2-(methyloxy)phenyl]methyl}benzenesulfonamide
Database identifiers
- CAS
330467-29-3- PubChem CID
- 668992
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 63.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 388
Physicochemical properties
- Boiling point
- 430 · 430.0±55.0 °C(Predicted)
- Density
- 1.289 · 1.289±0.06 g/cm3(Predicted)
- pka
- 10.86 · 10.86±0.50(Predicted)
Chemistry & industry
Suppliers2 total
SPECS[email protected]
VITAS-BB—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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