Basic information
- Standard SMILES
CC(C)(C)OC(=O)N=Cc1cccc(C(F)(F)F)c1- InChIKey
WZGQURUPXWCLLK-UHFFFAOYSA-N- Molecular formula
- C13H14F3NO2
- Average molar mass
- 273.25 g/mol
- Monoisotopic mass
- 273.09766318
Names & identifiers
- Preferred name
- tert-Butyl {(E)-[3-(trifluoromethyl)phenyl]methylidene}carbamate
- IUPAC
- tert-butyl N-[[3-(trifluoromethyl)phenyl]methylidene]carbamate
Names & synonyms
tert-Butyl {(E)-[3-(trifluoromethyl)phenyl]methylidene}carbamateSCHEMBL6916374WZGQURUPXWCLLK-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 69936178
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 345
Related reactions
1 records
Compound notes
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