Basic information
- CAS
53719-32-7- Standard SMILES
O=S(=O)(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F- InChIKey
SQRYBELQIKCWHR-UHFFFAOYSA-N- Molecular formula
- C9H4F9NO2S
- Average molar mass
- 361.19 g/mol
- Monoisotopic mass
- 360.981903
Names & identifiers
- Preferred name
- Methanesulfonamide, N-(3,5-bis(trifluoromethyl)phenyl)-1,1,1-trifluoro-
- IUPAC
- N-[3,5-bis(trifluoromethyl)phenyl]-1,1,1-trifluoromethanesulfonamide
Names & synonyms
Methanesulfonamide, N-(3,5-bis(trifluoromethyl)phenyl)-1,1,1-trifluoro-53719-32-7AI 3-10775n-[3,5-bis(trifluoromethyl)phenyl]-1,1,1-trifluoromethanesulfonamideSCHEMBL22582209DTXSID00968479SQRYBELQIKCWHR-UHFFFAOYSA-N
Database identifiers
- CAS
53719-32-7- PubChem CID
- 185752
- DTXSID
DTXSID00968479
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 465
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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