Methyl benzenesulfonylsulfanylformate
TL;DR: Methyl benzenesulfonylsulfanylformate (CAS 711-80-8) is a chemical compound with molecular formula C8H8O4S2 and molecular weight 231.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl benzenesulfonylsulfanylformate
Also Known As: methyl benzenesulfonylsulfanylformate, methyl 2-phenyldisulfanecarboxylate 2,2-dioxide, Methyl 2,2-dioxo-2-phenyl-2lambda~6~-disulfane-1-carboxylate
| Molecular Formula | C8H8O4S2 |
|---|---|
| Molecular Weight | 231.99 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 94.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.9864 |
| Heavy Atoms | 14 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 711-80-8 |
|---|---|
| SMILES | COC(=O)SS(=O)(=O)C1=CC=CC=C1 |
| InChIKey | SYPLPLCFYYEYSR-UHFFFAOYSA-N |
Product Overview
Methyl benzenesulfonylsulfanylformate (CAS 711-80-8), with molecular formula C8H8O4S2 and molecular weight 231.99 g/mol. IUPAC: methyl benzenesulfonylsulfanylformate.
Chemical Property Profile of Methyl benzenesulfonylsulfanylformate
Property Insights of Methyl benzenesulfonylsulfanylformate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl benzenesulfonylsulfanylformate. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl benzenesulfonylsulfanylformate. Following Lipinski's Rule of Five, Methyl benzenesulfonylsulfanylformate has 0 hydrogen bond donor(s) and 5 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 Methyl benzenesulfonylsulfanylformate?
The CAS number of Methyl benzenesulfonylsulfanylformate is 711-80-8.
What is the molecular formula of Methyl benzenesulfonylsulfanylformate?
The molecular formula of Methyl benzenesulfonylsulfanylformate is C8H8O4S2.
What is the molecular weight of Methyl benzenesulfonylsulfanylformate?
The molecular weight of Methyl benzenesulfonylsulfanylformate is 231.99 g/mol.
Where can I buy Methyl benzenesulfonylsulfanylformate?
You can request a quote for Methyl benzenesulfonylsulfanylformate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl benzenesulfonylsulfanylformate?
Yes, KEHONG BIO provides custom synthesis services for Methyl benzenesulfonylsulfanylformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.