1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone
TL;DR: 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone (CAS 161345-30-8) is a chemical compound with molecular formula C15H18O5 and molecular weight 278.11542 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-diacetyl-3-(furan-2-yl)-5-hydroxy-5-methylcyclohexan-1-one
Also Known As: 2,4-diacetyl-3-(2-furyl)-5-hydroxy-5-methyl-cyclohexan-1-one, 2,4-diacetyl-3-(furan-2-yl)-5-hydroxy-5-methylcyclohexan-1-one, 1,1'-(2-(furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone
Technical Specifications
| Molecular Formula | C15H18O5 |
| Molecular Weight | 278.11542 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 84.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.11542 Da |
| Heavy Atoms | 20 |
| Complexity | 444.0 |
| SMILES | CC(=O)C1C(C(C(CC1=O)(C)O)C(=O)C)C2=CC=CO2 |
| InChIKey | RRXVIQGKNXPOIT-UHFFFAOYSA-N |
Chemical Property Profile of 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone
Property Insights of 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone. Following Lipinski's Rule of Five, 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone?
The CAS number of 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone is 161345-30-8.
What is the molecular formula of 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone?
The molecular formula of 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone is C15H18O5.
What is the molecular weight of 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone?
The molecular weight of 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone is 278.11542 g/mol.
Where can I buy 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone?
You can request a quote for 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone?
Yes, CoreyChem provides custom synthesis services for 1,1'-(2-(Furan-2-yl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-diyl)diethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.