Basic information
- Standard SMILES
CN(CCc1ccc(Oc2cccc(C(F)(F)F)c2)cc1)C(=O)OC(C)(C)C- InChIKey
WZZZJWLLBRHDQO-UHFFFAOYSA-N- Molecular formula
- C21H24F3NO3
- Average molar mass
- 395.4 g/mol
Names & identifiers
- Preferred name
- Methyl-{2-[4-(3-trifluoromethyl-phenoxy)-phenyl]-ethyl}-carbamic acid tert-butyl ester
- IUPAC
- tert-butyl N-methyl-N-[2-[4-[3-(trifluoromethyl)phenoxy]phenyl]ethyl]carbamate
Names & synonyms
methyl-{2-[4-(3-trifluoromethyl-phenoxy)-phenyl]-ethyl}-carbamic acid tert-butyl esterSCHEMBL9104778
Database identifiers
- PubChem CID
- 67774263
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 496
Related reactions
3 records
Compound notes
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