Basic information
- Standard SMILES
O=C(O)c1cc(-c2ccc(C(F)(F)F)cc2)cs1- InChIKey
MNYKWNUPLPQNSM-UHFFFAOYSA-N- Molecular formula
- C12H7F3O2S
- Average molar mass
- 272.24 g/mol
Names & identifiers
- Preferred name
- 4-[4-(Trifluoromethyl)phenyl]thiophene-2-carboxylic acid
- IUPAC
- 4-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylic acid
Names & synonyms
4-[4-(trifluoromethyl)phenyl]thiophene-2-carboxylic acidSCHEMBL5862789
Database identifiers
- PubChem CID
- 21986512
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 65.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 311
Related reactions
4 records
Linked notes
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