2,5-Diethoxythiophenol
TL;DR: 2,5-Diethoxythiophenol (CAS 29236-93-9) is a chemical compound with molecular formula C10H14O2S and molecular weight 198.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diethoxybenzenethiol
Also Known As: 2,5-Diethoxythiophenol, 2,5-diethoxybenzenethiol, 2,5-Diethoxy thiophenol, 2,5-diethoxybenzene-1-thiol, Benzenethiol, 2,5-diethoxy-
| Molecular Formula | C10H14O2S |
|---|---|
| Molecular Weight | 198.07 g/mol |
| LogP | 2.7727 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 198.07146 |
| Heavy Atoms | 13 |
| Complexity | 273.6273 |
Chemical Identifiers
| CAS Number | 29236-93-9 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)OCC)S |
Product Overview
2,5-Diethoxythiophenol (CAS 29236-93-9), with molecular formula C10H14O2S and molecular weight 198.07 g/mol. IUPAC: 2,5-diethoxybenzenethiol.
Chemical Property Profile of 2,5-Diethoxythiophenol
Property Insights of 2,5-Diethoxythiophenol
The XLogP value of 2.7727 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Diethoxythiophenol. With a topological polar surface area (TPSA) of 18.46 Ų, 2,5-Diethoxythiophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Diethoxythiophenol has 1 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 2,5-Diethoxythiophenol?
The CAS number of 2,5-Diethoxythiophenol is 29236-93-9.
What is the molecular formula of 2,5-Diethoxythiophenol?
The molecular formula of 2,5-Diethoxythiophenol is C10H14O2S.
What is the molecular weight of 2,5-Diethoxythiophenol?
The molecular weight of 2,5-Diethoxythiophenol is 198.07 g/mol.
Where can I buy 2,5-Diethoxythiophenol?
You can request a quote for 2,5-Diethoxythiophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Diethoxythiophenol?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Diethoxythiophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.