![[2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate structure](/static/products/7911/79113-87-4.webp)
[2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate
TL;DR: [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate (CAS 79113-87-4) is a chemical compound with molecular formula C20H18O6S2 and molecular weight 418.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate
Also Known As: 1,2-bis(tosyloxy)benzene, [2-(4-methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate, 1,2-Phenylene bis(4-methylbenzene-1-sulfonate), 1-methyl-4-[2-(4-methylphenyl)sulfonyloxyphenoxy]sulfonyl-benzene, [2-(4-methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfona
| Molecular Formula | C20H18O6S2 |
|---|---|
| Molecular Weight | 418.05 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.05447 |
| Heavy Atoms | 28 |
| Complexity | 628.0 |
Chemical Identifiers
| CAS Number | 79113-87-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C |
| InChIKey | NQWBYJXDMSWXHX-UHFFFAOYSA-N |
Product Overview
[2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate (CAS 79113-87-4), with molecular formula C20H18O6S2 and molecular weight 418.05 g/mol. IUPAC: [2-(4-methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate.
Chemical Property Profile of [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate
Property Insights of [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate
The XLogP value of 4.8 indicates that [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate 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 [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate?
The CAS number of [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate is 79113-87-4.
What is the molecular formula of [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate?
The molecular formula of [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate is C20H18O6S2.
What is the molecular weight of [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate?
The molecular weight of [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate is 418.05 g/mol.
Where can I buy [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate?
You can request a quote for [2-(4-Methylphenyl)sulfonyloxyphenyl] 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-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Methylphenyl)sulfonyloxyphenyl] 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.