Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-
Basic information
- CAS
101030-73-3- Standard SMILES
O=C(C=C(C(F)(F)F)C(F)(F)F)c1cccc(S(=O)(=O)F)c1- InChIKey
QJPKZBQTZLBBJX-UHFFFAOYSA-N- Molecular formula
- C11H5F7O3S
- Average molar mass
- 350.21 g/mol
- Monoisotopic mass
- 349.98476233
Names & identifiers
- Preferred name
- Crotonophenone, 3'-fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethyl-
- IUPAC
- 3-[4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoyl]benzenesulfonyl fluoride
Names & synonyms
101030-73-3CROTONOPHENONE, 3'-FLUOROSULFONYL-4,4,4-TRIFLUORO-3-TRIFLUOROMETHYL-DTXSID50143693m-(4,4,4-Trifluoro-3-trifluoromethylcrotonyl) benzene-sulfonylfluorideRefChem:334509DTXCID3066184Benzenesulfonyl fluoride, 3-[4,4,4-trifluoro-1-oxo-3-(trifluoromethyl)-2-buten-1-yl]-NSC162342NSC-1623423-[4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoyl]benzene-1-sulfonyl fluoride3'-Fluorosulfonyl-4,4,4-trifluoro-3-trifluoromethylcrotonophenone
Database identifiers
- CAS
101030-73-3- PubChem CID
- 58157
- DTXSID
DTXSID50143693- Nikkaji
- J67.747G
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 538
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Compound notes
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