2,2,2-Trifluoro-N-[3-(4-methylbenzene-1-sulfinyl)propyl]acetamide
Basic information
- CAS
87943-29-1- Standard SMILES
Cc1ccc(S(=O)CCCNC(=O)C(F)(F)F)cc1- InChIKey
LDBDHLITYKPARC-UHFFFAOYSA-N- Molecular formula
- C12H14F3NO2S
- Average molar mass
- 293.31 g/mol
- Monoisotopic mass
- 293.06973435
Names & identifiers
- Preferred name
- 2,2,2-Trifluoro-N-[3-(4-methylbenzene-1-sulfinyl)propyl]acetamide
- IUPAC
- 2,2,2-trifluoro-N-[3-(4-methylphenyl)sulfinylpropyl]acetamide
Names & synonyms
87943-29-1DTXSID508313412,2,2-Trifluoro-N-[3-(4-methylbenzene-1-sulfinyl)propyl]acetamide
Database identifiers
- CAS
87943-29-1- PubChem CID
- 71411751
- DTXSID
DTXSID50831341
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 65.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 325
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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