N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
Basic information
- CAS
2805-88-1- Standard SMILES
O=S(=O)(Nc1cccc(C(F)(F)F)c1)c1ccccc1- InChIKey
YPMHGAUQQLJHJH-UHFFFAOYSA-N- Molecular formula
- C13H10F3NO2S
- Average molar mass
- 301.29 g/mol
- Monoisotopic mass
- 301.03843422
Names & identifiers
- Preferred name
- N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
- IUPAC
- N-[3-(trifluoromethyl)phenyl]benzenesulfonamide
- English name
- N-[3-(TrifluoroMethyl)phenyl]benzenesulfonaMide, 97%
- Molecular formula
- C13H10F3NO2S
- Molecular weight
- 301.28
Names & synonyms
N-[3-(trifluoromethyl)phenyl]benzenesulfonamide2805-88-1N-(3-(Trifluoromethyl)phenyl)benzenesulfonamideNSC164391TimTec1_000720CBDivE_011395SCHEMBL121452DTXSID00304156HMS1536A16STK090306AKOS000627110NSC-164391
Show more names
Benzenesulfonamide, N-[3-(trifluoromethyl)phenyl]-N-[3-(TrifluoroMethyl)phenyl]benzenesulfonaMide, 97%
NCGC00175191-01ST010897(phenylsulfonyl)[3-(trifluoromethyl)phenyl]amineBRD-K12144708-001-01-0
Database identifiers
- CAS
2805-88-1- PubChem CID
- 295231
- DTXSID
DTXSID00304156- EC Number
- 104-802-2
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 410
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
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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