Basic information
- Standard SMILES
CCC(O)CNc1ccc(Cl)c(C(F)(F)F)c1- InChIKey
SOHITNRXKYIHGZ-UHFFFAOYSA-N- Molecular formula
- C11H13ClF3NO
- Average molar mass
- 267.67 g/mol
Names & identifiers
- Preferred name
- 1-(3-Trifluoromethyl-4-chlorophenylamino)-2-butanol
- IUPAC
- 1-[4-chloro-3-(trifluoromethyl)anilino]butan-2-ol
Names & synonyms
1-(3-trifluoromethyl-4-chlorophenylamino)-2-butanolSCHEMBL10689579
Database identifiers
- PubChem CID
- 20152672
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 237
Related reactions
2 records
Compound notes
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