3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate
TL;DR: 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate (CAS 6329-36-8) is a chemical compound with molecular formula C17H20O6S2 and molecular weight 384.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate
Also Known As: 1,3-Bis(tosyloxy)propane, propane-1,3-diyl bis(4-methylbenzenesulfonate), 1,3-Propanediol di-p-toluenesulfonate, 1,3-Propanediol di-p-tosylate, propane-1,3-di-Tos
| Molecular Formula | C17H20O6S2 |
|---|---|
| Molecular Weight | 384.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 384.07013 |
| Heavy Atoms | 25 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 6329-36-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCCOS(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | ODVREDGIWSDQFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate (CAS 6329-36-8), with molecular formula C17H20O6S2 and molecular weight 384.07 g/mol. IUPAC: 3-(4-methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate.
Chemical Property Profile of 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate
Property Insights of 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate
The XLogP value of 3.3 indicates that 3-(4-Methylphenyl)sulfonyloxypropyl 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 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, 3-(4-Methylphenyl)sulfonyloxypropyl 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 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate?
The CAS number of 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate is 6329-36-8.
What is the molecular formula of 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate?
The molecular formula of 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate is C17H20O6S2.
What is the molecular weight of 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate?
The molecular weight of 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate is 384.07 g/mol.
Where can I buy 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate?
You can request a quote for 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.