2-Thiopheneethanol tosylate
TL;DR: 2-Thiopheneethanol tosylate (CAS 40412-06-4) is a chemical compound with molecular formula C13H14O3S2 and molecular weight 282.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-thiophen-2-ylethyl 4-methylbenzenesulfonate
Also Known As: 2-(Thiophen-2-yl)ethyl 4-methylbenzenesulfonate, 2-Thiopheneethanol Tosylate, 2-(2-Thienyl)ethyl toluene-p-sulphonate, Etynodiol, 2-(2-THIENYL)ETHYL 4-METHYLBENZENESULFONATE
| Molecular Formula | C13H14O3S2 |
|---|---|
| Molecular Weight | 282.04 g/mol |
| LogP | 3.00452 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 282.03842 |
| Heavy Atoms | 18 |
| Complexity | 583.6764 |
Chemical Identifiers
| CAS Number | 40412-06-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC=CS2 |
Product Overview
2-Thiopheneethanol tosylate (CAS 40412-06-4), with molecular formula C13H14O3S2 and molecular weight 282.04 g/mol. IUPAC: 2-thiophen-2-ylethyl 4-methylbenzenesulfonate.
Chemical Property Profile of 2-Thiopheneethanol tosylate
Property Insights of 2-Thiopheneethanol tosylate
The XLogP value of 3.00452 indicates that 2-Thiopheneethanol tosylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-Thiopheneethanol tosylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Thiopheneethanol tosylate has 0 hydrogen bond donor(s) and 4 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-Thiopheneethanol tosylate?
The CAS number of 2-Thiopheneethanol tosylate is 40412-06-4.
What is the molecular formula of 2-Thiopheneethanol tosylate?
The molecular formula of 2-Thiopheneethanol tosylate is C13H14O3S2.
What is the molecular weight of 2-Thiopheneethanol tosylate?
The molecular weight of 2-Thiopheneethanol tosylate is 282.04 g/mol.
Where can I buy 2-Thiopheneethanol tosylate?
You can request a quote for 2-Thiopheneethanol tosylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thiopheneethanol tosylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiopheneethanol tosylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.