N-(3-Fluorophenyl)benzenesulfonamide
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Basic information
- CAS
54129-14-5- Standard SMILES
O=S(=O)(Nc1cccc(F)c1)c1ccccc1- InChIKey
ZBASZKBDYLJNPV-UHFFFAOYSA-N- Molecular formula
- C12H10FNO2S
- Average molar mass
- 251.28 g/mol
- Monoisotopic mass
- 251.0416279
Names & identifiers
- Preferred name
- N-(3-Fluorophenyl)benzenesulfonamide
- IUPAC
- N-(3-fluorophenyl)benzenesulfonamide
- English name
- N-(3-fluorophenyl)benzenesulfonamide
- Molecular formula
- C12H10FNO2S
- Molecular weight
- 251.28
Names & synonyms
N-(3-fluorophenyl)benzenesulfonamide54129-14-5DTXSID10355134RefChem:361373DTXCID40306194Benzenesulfonamide, N-(3-fluorophenyl)-MFCD00440707(3-fluorophenyl)(phenylsulfonyl)amineSCHEMBL2566977HMS1580P05ECA12914STK411572
Show more names
AKOS001273281SB81934CS-0235714ST50909453EN300-16021AE-641/00009021Z45634173
Database identifiers
- CAS
54129-14-5- PubChem CID
- 792117
- DTXSID
DTXSID10355134
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 333
Physicochemical properties
- Boiling point
- 374.9 · 374.9±44.0 °C(Predicted)
- Density
- 1.374 · 1.374±0.06 g/cm3(Predicted)
- pka
- 7.3 · 7.30±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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