p-Toluenesulfonic acid, thio-, S-decyl ester
TL;DR: p-Toluenesulfonic acid, thio-, S-decyl ester (CAS 28519-33-7) is a chemical compound with molecular formula C17H28O2S2 and molecular weight 328.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-decylsulfanylsulfonyl-4-methylbenzene
Also Known As: S-Decyl p-toluenethiosulfonate, S-Decyl 4-methylbenzenesulfonothioate, p-Toluenesulfonic acid, thio-, S-decyl ester, 1-decylsulfanylsulfonyl-4-methylbenzene, p-Toluenesulfonic acid, S-decyl ester
| Molecular Formula | C17H28O2S2 |
|---|---|
| Molecular Weight | 328.15 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 328.15308 |
| Heavy Atoms | 21 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 28519-33-7 |
|---|---|
| SMILES | CCCCCCCCCCSS(=O)(=O)C1=CC=C(C=C1)C |
| InChIKey | BJWRHSVAOWXOSZ-UHFFFAOYSA-N |
Product Overview
p-Toluenesulfonic acid, thio-, S-decyl ester (CAS 28519-33-7), with molecular formula C17H28O2S2 and molecular weight 328.15 g/mol. IUPAC: 1-decylsulfanylsulfonyl-4-methylbenzene.
Chemical Property Profile of p-Toluenesulfonic acid, thio-, S-decyl ester
Property Insights of p-Toluenesulfonic acid, thio-, S-decyl ester
The XLogP value of 6.5 indicates that p-Toluenesulfonic acid, thio-, S-decyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Toluenesulfonic acid, thio-, S-decyl ester. Following Lipinski's Rule of Five, p-Toluenesulfonic acid, thio-, S-decyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of p-Toluenesulfonic acid, thio-, S-decyl ester?
The CAS number of p-Toluenesulfonic acid, thio-, S-decyl ester is 28519-33-7.
What is the molecular formula of p-Toluenesulfonic acid, thio-, S-decyl ester?
The molecular formula of p-Toluenesulfonic acid, thio-, S-decyl ester is C17H28O2S2.
What is the molecular weight of p-Toluenesulfonic acid, thio-, S-decyl ester?
The molecular weight of p-Toluenesulfonic acid, thio-, S-decyl ester is 328.15 g/mol.
Where can I buy p-Toluenesulfonic acid, thio-, S-decyl ester?
You can request a quote for p-Toluenesulfonic acid, thio-, S-decyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Toluenesulfonic acid, thio-, S-decyl ester?
Yes, KEHONG BIO provides custom synthesis services for p-Toluenesulfonic acid, thio-, S-decyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.