Basic information
- Standard SMILES
COc1cc2scc(C(=O)O)c2cc1C(F)(F)F- InChIKey
MKSOAQLRCRQAMJ-UHFFFAOYSA-N- Molecular formula
- C11H7F3O3S
- Average molar mass
- 276.23 g/mol
Names & identifiers
- Preferred name
- 5-Trifluoromethyl-6-methoxybenzo[b]thiophene-3-carboxylic acid
- IUPAC
- 6-methoxy-5-(trifluoromethyl)-1-benzothiophene-3-carboxylic acid
Names & synonyms
5-Trifluoromethyl-6-methoxybenzo[b]thiophene-3-carboxylic acidSCHEMBL8428092
Database identifiers
- PubChem CID
- 54077474
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 334
Related reactions
2 records
Compound notes
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