![8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one structure](/static/products/5727/57274-39-2.webp)
8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one
TL;DR: 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one (CAS 57274-39-2) is a chemical compound with molecular formula C10H16O2S and molecular weight 200.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one
Also Known As: 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one, 2-hydroxy-2,4,7-trimethyl-8-thiabicyclo[2.2.2]octan-6-one, 2-Thiabicyclo[2.2.2]octan-5-one, 8-hydroxy-1,3,8-trimethyl-, 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one #
| Molecular Formula | C10H16O2S |
|---|---|
| Molecular Weight | 200.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 200.0871 |
| Heavy Atoms | 13 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 57274-39-2 |
|---|---|
| SMILES | CC1C2C(=O)CC(S1)(CC2(C)O)C |
| InChIKey | WVBMTQHSHWRRAA-UHFFFAOYSA-N |
Product Overview
8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one (CAS 57274-39-2), with molecular formula C10H16O2S and molecular weight 200.09 g/mol. IUPAC: 8-hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one.
Chemical Property Profile of 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one
Property Insights of 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one. Following Lipinski's Rule of Five, 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-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 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one?
The CAS number of 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one is 57274-39-2.
What is the molecular formula of 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one?
The molecular formula of 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one is C10H16O2S.
What is the molecular weight of 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one?
The molecular weight of 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one is 200.09 g/mol.
Where can I buy 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one?
You can request a quote for 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.