![[2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate structure](/static/products/169/169613-81-4.png)
[2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate
TL;DR: [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate (CAS 169613-81-4) is a chemical compound with molecular formula C15H18O8S and molecular weight 358.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate
Also Known As: [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate
| Molecular Formula | C15H18O8S |
|---|---|
| Molecular Weight | 358.07 g/mol |
| LogP | 0.49102 |
| Topological Polar Surface Area | 108.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 358.07224 |
| Heavy Atoms | 24 |
| Complexity | 735.2425 |
Chemical Identifiers
| CAS Number | 169613-81-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC(C2C(=C(C(=O)O2)OC)OC)O |
Product Overview
[2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate (CAS 169613-81-4), with molecular formula C15H18O8S and molecular weight 358.07 g/mol. IUPAC: [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate.
Chemical Property Profile of [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate
Property Insights of [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate
The XLogP value of 0.49102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate. The TPSA of 108.36 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate has 1 hydrogen bond donor(s) and 8 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 [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate?
The CAS number of [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate is 169613-81-4.
What is the molecular formula of [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate?
The molecular formula of [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate is C15H18O8S.
What is the molecular weight of [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate?
The molecular weight of [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate is 358.07 g/mol.
Where can I buy [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate?
You can request a quote for [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [2-(3,4-dimethoxy-5-oxo-2H-furan-2-yl)-2-hydroxyethyl] 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.