2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate
TL;DR: 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate (CAS 14543-49-8) is a chemical compound with molecular formula C16H18O3S and molecular weight 290.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)ethyl 4-methylbenzenesulfonate
Also Known As: 2-p-tolylethyl tosylate, 4-methylphenethyl tosylate, 2-(4-methylphenyl)ethyl tosylate, Cyclopentanone,2-(4-methylphenyl), 2-(4-methylphenyl)ethyl 4-methylbenzenesulfonate
| Molecular Formula | C16H18O3S |
|---|---|
| Molecular Weight | 290.10 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.09766 |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 14543-49-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CCOS(=O)(=O)C2=CC=C(C=C2)C |
| InChIKey | DBLJZZQZTIXACJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate (CAS 14543-49-8), with molecular formula C16H18O3S and molecular weight 290.10 g/mol. IUPAC: 2-(4-methylphenyl)ethyl 4-methylbenzenesulfonate.
Chemical Property Profile of 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate
Property Insights of 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate
The XLogP value of 3.8 indicates that 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate has 0 hydrogen bond donor(s) and 3 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)ethyl 4-methylbenzenesulfonate?
The CAS number of 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate is 14543-49-8.
What is the molecular formula of 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate?
The molecular formula of 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate is C16H18O3S.
What is the molecular weight of 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate?
The molecular weight of 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate is 290.10 g/mol.
Where can I buy 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate?
You can request a quote for 2-(4-Methylphenyl)ethyl 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)ethyl 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylphenyl)ethyl 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.