![1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) structure](/static/products/7224/7224-55-7.webp)
1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one)
TL;DR: 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) (CAS 7224-55-7) is a chemical compound with molecular formula C13H20O3 and molecular weight 224.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-acetyl-5-hydroxy-2,2-dimethyl-7-bicyclo[4.1.0]heptanyl)ethanone
Also Known As: 1,7-diacetyl-5-hydroxy-2,2-dimethylbicyclo[4.1.0]heptane, 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one), 1-(1-acetyl-5-hydroxy-2,2-dimethyl-7-bicyclo[4.1.0]heptyl)ethanone, 1-(6-acetyl-2-hydroxy-5,5-dimethyl-7-bicyclo[4.1.0]heptanyl)ethanone, Ethanone, 1,1'-(5-hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)bis-, (1.alpha.,5.beta.,6.alpha.,7.alpha.)-
| Molecular Formula | C13H20O3 |
|---|---|
| Molecular Weight | 224.14 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 224.14125 |
| Heavy Atoms | 16 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 7224-55-7 |
|---|---|
| SMILES | CC(=O)C1C2C1(C(CCC2O)(C)C)C(=O)C |
| InChIKey | IESYWAXARGFDNW-UHFFFAOYSA-N |
Product Overview
1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) (CAS 7224-55-7), with molecular formula C13H20O3 and molecular weight 224.14 g/mol. IUPAC: 1-(1-acetyl-5-hydroxy-2,2-dimethyl-7-bicyclo[4.1.0]heptanyl)ethanone.
Chemical Property Profile of 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one)
Property Insights of 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one)
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one). With a topological polar surface area (TPSA) of 54.4 Ų, 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one)?
The CAS number of 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) is 7224-55-7.
What is the molecular formula of 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one)?
The molecular formula of 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) is C13H20O3.
What is the molecular weight of 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one)?
The molecular weight of 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) is 224.14 g/mol.
Where can I buy 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one)?
You can request a quote for 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-(5-Hydroxy-2,2-dimethylbicyclo[4.1.0]heptane-1,7-diyl)di(ethan-1-one) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.