2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate
TL;DR: 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate (CAS 84183-96-0) is a chemical compound with molecular formula C14H20O5S and molecular weight 300.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-prop-2-enoxyethoxy)ethyl 4-methylbenzenesulfonate
Also Known As: 2-(2-(Allyloxy)ethoxy)ethyl 4-methylbenzenesulfonate, 2-(2-(allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate, 2-[2-(prop-2-en-1-yloxy)ethoxy]ethyl 4-methylbenzene-1-sulfonate, A1-06431, Toluene-4-sulfonic acid 2-(2-allyloxyethoxy)-ethyl ester
| Molecular Formula | C14H20O5S |
|---|---|
| Molecular Weight | 300.10 g/mol |
| LogP | 1.91952 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 300.10315 |
| Heavy Atoms | 20 |
| Complexity | 492.80048 |
Chemical Identifiers
| CAS Number | 84183-96-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCC=C |
Product Overview
2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate (CAS 84183-96-0), with molecular formula C14H20O5S and molecular weight 300.10 g/mol. IUPAC: 2-(2-prop-2-enoxyethoxy)ethyl 4-methylbenzenesulfonate.
Chemical Property Profile of 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate
Property Insights of 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate
The XLogP value of 1.91952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate. Following Lipinski's Rule of Five, 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate 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 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate?
The CAS number of 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate is 84183-96-0.
What is the molecular formula of 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate?
The molecular formula of 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate is C14H20O5S.
What is the molecular weight of 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate?
The molecular weight of 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate is 300.10 g/mol.
Where can I buy 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate?
You can request a quote for 2-(2-(Allyloxy)ethoxy)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-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-(Allyloxy)ethoxy)ethyl-4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.