Basic information
- Standard SMILES
O=C(O)Cc1ccc(Oc2ccc(C(F)(F)F)cn2)c(Cl)c1- InChIKey
PRHPJBXWMYWGOP-UHFFFAOYSA-N- Molecular formula
- C14H9ClF3NO3
- Average molar mass
- 331.67 g/mol
- Monoisotopic mass
- 331.0223053
Names & identifiers
- Preferred name
- 3-Chloro-4-[(5-trifluoromethylpyridin-2-yl)oxy]phenylacetic acid
- IUPAC
- 2-[3-chloro-4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenyl]acetic acid
Names & synonyms
3-chloro-4-[(5-trifluoromethylpyridin-2-yl)oxy]phenylacetic acidSCHEMBL8413439
Database identifiers
- PubChem CID
- 19082074
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 59.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 394
Related reactions
2 records
Compound notes
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