Toluene-p-sulphonic anhydride
TL;DR: Toluene-p-sulphonic anhydride (CAS 4124-41-8) is a chemical compound with molecular formula C14H14O5S2 and molecular weight 326.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl)sulfonyl 4-methylbenzenesulfonate
Also Known As: p-Toluenesulfonic anhydride, 4-Methylbenzenesulfonic anhydride, 4-Toluenesulfonic anhydride, tosic anhydride, 9-Hydroxyrisperidone
| Molecular Formula | C14H14O5S2 |
|---|---|
| Molecular Weight | 326.03 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 94.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.02826 |
| Heavy Atoms | 21 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 4124-41-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OS(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | PDVFSPNIEOYOQL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Toluene-p-sulphonic anhydride (CAS 4124-41-8), with molecular formula C14H14O5S2 and molecular weight 326.03 g/mol. IUPAC: (4-methylphenyl)sulfonyl 4-methylbenzenesulfonate.
Chemical Property Profile of Toluene-p-sulphonic anhydride
Property Insights of Toluene-p-sulphonic anhydride
The XLogP value of 3.1 indicates that Toluene-p-sulphonic anhydride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Toluene-p-sulphonic anhydride. Following Lipinski's Rule of Five, Toluene-p-sulphonic anhydride 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 Toluene-p-sulphonic anhydride?
The CAS number of Toluene-p-sulphonic anhydride is 4124-41-8.
What is the molecular formula of Toluene-p-sulphonic anhydride?
The molecular formula of Toluene-p-sulphonic anhydride is C14H14O5S2.
What is the molecular weight of Toluene-p-sulphonic anhydride?
The molecular weight of Toluene-p-sulphonic anhydride is 326.03 g/mol.
Where can I buy Toluene-p-sulphonic anhydride?
You can request a quote for Toluene-p-sulphonic anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Toluene-p-sulphonic anhydride?
Yes, KEHONG BIO provides custom synthesis services for Toluene-p-sulphonic anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.