Basic information
- Standard SMILES
Cc1ccc(C=CC(=O)c2ccc(C)cc2)cc1- InChIKey
DTEBZGKINVACPT-UHFFFAOYSA-N- Molecular formula
- C17H16O
- Average molar mass
- 236.31 g/mol
Names & identifiers
- Preferred name
- 1,3-Bis(4-methylphenyl)prop-2-en-1-one
- IUPAC
- 1,3-bis(4-methylphenyl)prop-2-en-1-one
Names & synonyms
1,3-Di-p-tolylprop-2-en-1-one1,3-bis(4-methylphenyl)prop-2-en-1-oneNCIOpen2_004759SCHEMBL979560DTEBZGKINVACPT-UHFFFAOYSA-NXVC588991,3-bis(p-tolyl)prop-2-en-1-oneAKOS017085668
Database identifiers
- PubChem CID
- 256552
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 289
Related reactions
2 records
Linked notes
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