2,2'-(1-Phenylprop-1-yne-3,3-diyl)bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one)
3-hydroxy-2-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-3-phenylprop-2-ynyl]-5,5-dimethylcyclohex-2-en-1-one
Also Known As: Oprea1_462420|AE-848/12123110|2,2'-(1-phenylprop-1-yne-3,3-diyl)bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one)|2,2'-(3-phenylprop-2-yne-1,1-diyl)bis(3-hydroxy-5,5-dimethylcyclohex-2-enone)|3-hydroxy-2-[1-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3-phenyl-2-propynyl]-5,5-dimethyl-2-cyclohexen-1-one
| Molecular Formula | C25H28O4 |
|---|---|
| Molecular Weight | 392.19876 g/mol |
| LogP | 5.0567 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 392.19876 |
| Monoisotopic Mass | 392.19876 |
| Heavy Atoms | 29 |
| Complexity | 913.07086 |
Chemical Identifiers
| CAS Number | 112403-24-4 |
|---|---|
| SMILES | CC1(CC(=C(C(=O)C1)C(C#CC2=CC=CC=C2)C3=C(CC(CC3=O)(C)C)O)O)C |
Product Overview
2,2'-(1-Phenylprop-1-yne-3,3-diyl)bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one) (CAS 112403-24-4), with molecular formula C25H28O4 and molecular weight 392.19876 g/mol. IUPAC: 3-hydroxy-2-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-3-phenylprop-2-ynyl]-5,5-dimethylcyclohex-2-en-1-one.
2,2'-(1-Phenylprop-1-yne-3,3-diyl)bis(3-hydroxy-5,5-dimethylcyclohex-2-en-1-one) is a custom synthesis product. We offer services from milligram to kilogram scale.
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