![[(3R,5S)-4-oxo-1-adamantyl] acetate structure](/static/products/6338/63382-10-5.webp)
[(3R,5S)-4-oxo-1-adamantyl] acetate
TL;DR: [(3R,5S)-4-oxo-1-adamantyl] acetate (CAS 63382-10-5) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3R,5S)-4-oxo-1-adamantyl] acetate
Also Known As: 4-Oxo-1-adamantyl acetate, Acetic acid 4-oxoadamantan-1-yl ester, (3R,5S)-4-oxoadamantan-1-yl acetate, [(3R,5S)-4-oxo-1-adamantyl] acetate
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 63382-10-5 |
|---|---|
| SMILES | CC(=O)OC12C[C@H]3CC(C1)C[C@@H](C2)C3=O |
| InChIKey | HXHDLUJUHIBGGK-PYDJHFLYSA-N |
Product Overview
[(3R,5S)-4-oxo-1-adamantyl] acetate (CAS 63382-10-5), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: [(3R,5S)-4-oxo-1-adamantyl] acetate.
Chemical Property Profile of [(3R,5S)-4-oxo-1-adamantyl] acetate
Property Insights of [(3R,5S)-4-oxo-1-adamantyl] acetate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(3R,5S)-4-oxo-1-adamantyl] acetate. With a topological polar surface area (TPSA) of 43.4 Ų, [(3R,5S)-4-oxo-1-adamantyl] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(3R,5S)-4-oxo-1-adamantyl] acetate has 0 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 [(3R,5S)-4-oxo-1-adamantyl] acetate?
The CAS number of [(3R,5S)-4-oxo-1-adamantyl] acetate is 63382-10-5.
What is the molecular formula of [(3R,5S)-4-oxo-1-adamantyl] acetate?
The molecular formula of [(3R,5S)-4-oxo-1-adamantyl] acetate is C12H16O3.
What is the molecular weight of [(3R,5S)-4-oxo-1-adamantyl] acetate?
The molecular weight of [(3R,5S)-4-oxo-1-adamantyl] acetate is 208.11 g/mol.
Where can I buy [(3R,5S)-4-oxo-1-adamantyl] acetate?
You can request a quote for [(3R,5S)-4-oxo-1-adamantyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(3R,5S)-4-oxo-1-adamantyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [(3R,5S)-4-oxo-1-adamantyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.