1-Adamantylmethyl methanesulfonate
TL;DR: 1-Adamantylmethyl methanesulfonate (CAS 40426-24-2) is a chemical compound with molecular formula C12H20O3S and molecular weight 244.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-adamantylmethyl methanesulfonate
Also Known As: 1-adamantylmethyl methanesulfonate, Adamant-1-ylmethyl methanesulfonate, adamantan-1-ylmethyl methanesulfonate, Tricyclo[3.3.1.13,7]decane-1-methanol, 1-methanesulfonate
| Molecular Formula | C12H20O3S |
|---|---|
| Molecular Weight | 244.11 g/mol |
| LogP | 2.179 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.11331 |
| Heavy Atoms | 16 |
| Complexity | 349.78384 |
Chemical Identifiers
| CAS Number | 40426-24-2 |
|---|---|
| SMILES | CS(=O)(=O)OCC12CC3CC(C1)CC(C3)C2 |
Product Overview
1-Adamantylmethyl methanesulfonate (CAS 40426-24-2), with molecular formula C12H20O3S and molecular weight 244.11 g/mol. IUPAC: 1-adamantylmethyl methanesulfonate.
Chemical Property Profile of 1-Adamantylmethyl methanesulfonate
Property Insights of 1-Adamantylmethyl methanesulfonate
The XLogP value of 2.179 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Adamantylmethyl methanesulfonate. With a topological polar surface area (TPSA) of 43.37 Ų, 1-Adamantylmethyl methanesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Adamantylmethyl methanesulfonate 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 1-Adamantylmethyl methanesulfonate?
The CAS number of 1-Adamantylmethyl methanesulfonate is 40426-24-2.
What is the molecular formula of 1-Adamantylmethyl methanesulfonate?
The molecular formula of 1-Adamantylmethyl methanesulfonate is C12H20O3S.
What is the molecular weight of 1-Adamantylmethyl methanesulfonate?
The molecular weight of 1-Adamantylmethyl methanesulfonate is 244.11 g/mol.
Where can I buy 1-Adamantylmethyl methanesulfonate?
You can request a quote for 1-Adamantylmethyl methanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Adamantylmethyl methanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 1-Adamantylmethyl methanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.