![[4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate structure](/static/products/868/86801-03-8.png)
[4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate
TL;DR: [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate (CAS 86801-03-8) is a chemical compound with molecular formula C18H18O6S and molecular weight 362.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate
Also Known As: sodium,5-hexadecyl-2-hydroxybenzoate, sodium 5-hexadecyl-2-hydroxybenzoate, sulfonylbis-2-methylbenzene-4,1-diyl diacetate, Sulfonylbis(2-methyl-4,1-phenylene) diacetate, [4-(4-acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate
| Molecular Formula | C18H18O6S |
|---|---|
| Molecular Weight | 362.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 95.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.0824 |
| Heavy Atoms | 25 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 86801-03-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)S(=O)(=O)C2=CC(=C(C=C2)OC(=O)C)C)OC(=O)C |
| InChIKey | UXRHLPHEBUZWBN-UHFFFAOYSA-N |
Product Overview
[4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate (CAS 86801-03-8), with molecular formula C18H18O6S and molecular weight 362.08 g/mol. IUPAC: [4-(4-acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate.
Chemical Property Profile of [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate
Property Insights of [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate
The XLogP value of 3.0 indicates that [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate. Following Lipinski's Rule of Five, [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate 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 [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate?
The CAS number of [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate is 86801-03-8.
What is the molecular formula of [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate?
The molecular formula of [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate is C18H18O6S.
What is the molecular weight of [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate?
The molecular weight of [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate is 362.08 g/mol.
Where can I buy [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate?
You can request a quote for [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [4-(4-Acetyloxy-3-methylphenyl)sulfonyl-2-methylphenyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.