Basic information
- Standard SMILES
CC(C)=CC=C(c1ccccc1)C(F)(F)F- InChIKey
DTGMLBJOZLYVRD-UHFFFAOYSA-N- Molecular formula
- C13H13F3
- Average molar mass
- 226.24 g/mol
Names & identifiers
- Preferred name
- 1,1,1-Trifluoro-2-phenyl-5-methyl-hexa-2,4-diene
- IUPAC
- (1,1,1-trifluoro-5-methylhexa-2,4-dien-2-yl)benzene
Names & synonyms
1,1,1-trifluoro-2-phenyl-5-methyl-hexa-2,4-dieneSCHEMBL11043916
Database identifiers
- PubChem CID
- 53778039
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 274
Related reactions
1 records
Linked notes
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