![3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan structure](/static/products/6915/6915-71-5.webp)
3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan
TL;DR: 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan (CAS 6915-71-5) is a chemical compound with molecular formula C11H16O5S and molecular weight 260.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
Also Known As: 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan, 3-{[2-(Methylsulfanyl)ethoxy]carbonyl}-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid, 6-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-5-carboxylic acid
| Molecular Formula | C11H16O5S |
|---|---|
| Molecular Weight | 260.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 98.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 260.07184 |
| Heavy Atoms | 17 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 6915-71-5 |
|---|---|
| SMILES | CSCCOC(=O)C1C2CCC(C1C(=O)O)O2 |
| InChIKey | RNBITUPTTPEOLD-UHFFFAOYSA-N |
Product Overview
3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan (CAS 6915-71-5), with molecular formula C11H16O5S and molecular weight 260.07 g/mol. IUPAC: 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid.
Chemical Property Profile of 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan
Property Insights of 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan. Following Lipinski's Rule of Five, 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan has 1 hydrogen bond donor(s) and 6 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 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan?
The CAS number of 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan is 6915-71-5.
What is the molecular formula of 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan?
The molecular formula of 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan is C11H16O5S.
What is the molecular weight of 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan?
The molecular weight of 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan is 260.07 g/mol.
Where can I buy 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan?
You can request a quote for 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-methylsulfanylethoxycarbonyl)-7-oxabicyclo[2.2.1]heptan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.