Basic information
- Standard SMILES
CCOC(=O)c1ccc(C(F)(F)F)c(N)c1- InChIKey
YNNQZTINJDSFGJ-UHFFFAOYSA-N- Molecular formula
- C10H10F3NO2
- Average molar mass
- 233.19 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-amino-4-(trifluoromethyl)benzoate
- IUPAC
- ethyl 3-amino-4-(trifluoromethyl)benzoate
Names & synonyms
ethyl 3-amino-4-(trifluoromethyl)benzoate154057-15-5SCHEMBL12643583-AMINO-4-(TRIFLUOROMETHYL)BENZOIC ACID ETHYL ESTERDA-09905EN300-67475042-amino-alpha,alpha,alpha-trifluoro-p-toluic acid ethyl ester
Database identifiers
- PubChem CID
- 19783159
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 255
Related reactions
11 records
Compound notes
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