1-(4-Dodecylphenyl)-1,3-dioxo-3-phenylpropan-2-YL acetate
Basic information
- CAS
60615-32-9- Standard SMILES
CCCCCCCCCCCCc1ccc(C(=O)C(OC(C)=O)C(=O)c2ccccc2)cc1- InChIKey
PVYYUZVCBSSRGO-UHFFFAOYSA-N- Molecular formula
- C29H38O4
- Average molar mass
- 450.6 g/mol
- Monoisotopic mass
- 450.27700969
Names & identifiers
- Preferred name
- 1-(4-Dodecylphenyl)-1,3-dioxo-3-phenylpropan-2-YL acetate
- IUPAC
- [1-(4-dodecylphenyl)-1,3-dioxo-3-phenylpropan-2-yl] acetate
Names & synonyms
60615-32-9DTXSID008218381-(4-DODECYLPHENYL)-1,3-DIOXO-3-PHENYLPROPAN-2-YL ACETATE
Database identifiers
- CAS
60615-32-9- PubChem CID
- 71400567
- DTXSID
DTXSID00821838
Properties
Computed structural properties
- XLogP
- 9.4
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 570
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Compound notes
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