![Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate structure](/static/products/791/791798-83-9.png)
Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate
TL;DR: Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate (CAS 791798-83-9) is a chemical compound with molecular formula C16H16O6S and molecular weight 336.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(benzenesulfonyloxy)-3-methoxybenzoate
Also Known As: ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate, ethyl 4-(benzenesulfonyloxy)-3-methoxybenzoate, AN-652/43161970
| Molecular Formula | C16H16O6S |
|---|---|
| Molecular Weight | 336.07 g/mol |
| LogP | 2.6396 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.06677 |
| Heavy Atoms | 23 |
| Complexity | 783.4727 |
Chemical Identifiers
| CAS Number | 791798-83-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC=C2)OC |
Product Overview
Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate (CAS 791798-83-9), with molecular formula C16H16O6S and molecular weight 336.07 g/mol. IUPAC: ethyl 4-(benzenesulfonyloxy)-3-methoxybenzoate.
Chemical Property Profile of Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate
Property Insights of Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate
The XLogP value of 2.6396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate. Following Lipinski's Rule of Five, Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate has 0 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 Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate?
The CAS number of Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate is 791798-83-9.
What is the molecular formula of Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate?
The molecular formula of Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate is C16H16O6S.
What is the molecular weight of Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate?
The molecular weight of Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate is 336.07 g/mol.
Where can I buy Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate?
You can request a quote for Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-methoxy-4-[(phenylsulfonyl)oxy]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.