Basic information
- Standard SMILES
Cl.NCC(=O)Cc1cccc(C(F)(F)F)c1- InChIKey
IJWCTPAEEOFVMT-UHFFFAOYSA-N- Molecular formula
- C10H11ClF3NO
- Average molar mass
- 253.65 g/mol
Names & identifiers
- Preferred name
- 1-Amino-3-[3-(trifluoromethyl)phenyl]acetone hydrochloride
- IUPAC
- 1-amino-3-[3-(trifluoromethyl)phenyl]propan-2-one;hydrochloride
Names & synonyms
1-Amino-3-[3-(trifluoromethyl)phenyl]acetone hydrochlorideSCHEMBL1295331
Database identifiers
- PubChem CID
- 53403162
Properties
Computed structural properties
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 227
Related reactions
1 records
Compound notes
Loading…