1-(3-Methylphenyl)-1,3-dioxo-3-phenylpropan-2-yl acetate
Basic information
- CAS
60615-29-4- Standard SMILES
CC(=O)OC(C(=O)c1ccccc1)C(=O)c1cccc(C)c1- InChIKey
FMGXSXAPLPGHOX-UHFFFAOYSA-N- Molecular formula
- C18H16O4
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.10485899
Names & identifiers
- Preferred name
- 1-(3-Methylphenyl)-1,3-dioxo-3-phenylpropan-2-yl acetate
- IUPAC
- [1-(3-methylphenyl)-1,3-dioxo-3-phenylpropan-2-yl] acetate
Names & synonyms
60615-29-4DTXSID308218411-(3-Methylphenyl)-1,3-dioxo-3-phenylpropan-2-yl acetate
Database identifiers
- CAS
60615-29-4- PubChem CID
- 71400570
- DTXSID
DTXSID30821841
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…