1,3-Pentanedione, 2,4,4-trimethyl-1-phenyl-
2,4,4-trimethyl-1-phenylpentane-1,3-dione
Also Known As: ACMC-20bfde|1,3-Pentanedione, 2,4,4-trimethyl-1-phenyl-|2,4,4-trimethyl-1-phenylpentane-1,3-dione|2,4,4-Trimethyl-1-phenyl-1,3-pentanedione|2,4,4-Trimethyl-1-phenyl-1,3-pentanedione #
CAS: 106596-69-4
| Molecular Formula | C14H18O2 |
|---|---|
| Molecular Weight | 218.13068 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.13068 |
| Monoisotopic Mass | 218.13068 |
| Heavy Atoms | 16 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 106596-69-4 |
|---|---|
| SMILES | CC(C(=O)C1=CC=CC=C1)C(=O)C(C)(C)C |
| InChIKey | IJGILMHSYIOLMA-UHFFFAOYSA-N |
Product Overview
1,3-Pentanedione, 2,4,4-trimethyl-1-phenyl- (CAS 106596-69-4), with molecular formula C14H18O2 and molecular weight 218.13068 g/mol. IUPAC: 2,4,4-trimethyl-1-phenylpentane-1,3-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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1,3-Pentanedione, 2,4,4-trimethyl-1-phenyl- is a custom synthesis product. We offer services from milligram to kilogram scale.
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