Methanesulfonic acid, 4-oxoadamantan-2-yl ester
TL;DR: Methanesulfonic acid, 4-oxoadamantan-2-yl ester (CAS 23014-71-3) is a chemical compound with molecular formula C11H16O4S and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-oxo-2-adamantyl) methanesulfonate
Also Known As: 4-Oxo-2-adamantyl methanesulfonate, 4-methanesulfonyloxy-2-adamantanone, (4-oxo-2-adamantyl) methanesulfonate, 4-Oxo-2-adamantyl methanesulfonate #, Methanesulfonic acid, 4-oxoadamantan-2-yl ester
| Molecular Formula | C11H16O4S |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 68.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.07693 |
| Heavy Atoms | 16 |
| Complexity | 422.0 |
Chemical Identifiers
| CAS Number | 23014-71-3 |
|---|---|
| SMILES | CS(=O)(=O)OC1C2CC3CC(C2)C(=O)C1C3 |
| InChIKey | MDQQKUIUCFPSJG-UHFFFAOYSA-N |
Product Overview
Methanesulfonic acid, 4-oxoadamantan-2-yl ester (CAS 23014-71-3), with molecular formula C11H16O4S and molecular weight 244.08 g/mol. IUPAC: (4-oxo-2-adamantyl) methanesulfonate.
Chemical Property Profile of Methanesulfonic acid, 4-oxoadamantan-2-yl ester
Property Insights of Methanesulfonic acid, 4-oxoadamantan-2-yl ester
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methanesulfonic acid, 4-oxoadamantan-2-yl ester. The TPSA of 68.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methanesulfonic acid, 4-oxoadamantan-2-yl ester. Following Lipinski's Rule of Five, Methanesulfonic acid, 4-oxoadamantan-2-yl ester has 0 hydrogen bond donor(s) and 4 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 Methanesulfonic acid, 4-oxoadamantan-2-yl ester?
The CAS number of Methanesulfonic acid, 4-oxoadamantan-2-yl ester is 23014-71-3.
What is the molecular formula of Methanesulfonic acid, 4-oxoadamantan-2-yl ester?
The molecular formula of Methanesulfonic acid, 4-oxoadamantan-2-yl ester is C11H16O4S.
What is the molecular weight of Methanesulfonic acid, 4-oxoadamantan-2-yl ester?
The molecular weight of Methanesulfonic acid, 4-oxoadamantan-2-yl ester is 244.08 g/mol.
Where can I buy Methanesulfonic acid, 4-oxoadamantan-2-yl ester?
You can request a quote for Methanesulfonic acid, 4-oxoadamantan-2-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanesulfonic acid, 4-oxoadamantan-2-yl ester?
Yes, KEHONG BIO provides custom synthesis services for Methanesulfonic acid, 4-oxoadamantan-2-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.