3-Ethoxybenzenethiol
TL;DR: 3-Ethoxybenzenethiol (CAS 86704-82-7) is a chemical compound with molecular formula C8H10OS and molecular weight 154.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxybenzenethiol
Also Known As: 3-Ethoxythiophenol, 3-ethoxybenzenethiol, 3-Ethoxy thiophenol, 3'-Thiophenetole, 3-ethoxybenzene-1-thiol
| Molecular Formula | C8H10OS |
|---|---|
| Molecular Weight | 154.05 g/mol |
| LogP | 2.374 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.04524 |
| Heavy Atoms | 10 |
| Complexity | 210.1675 |
Chemical Identifiers
| CAS Number | 86704-82-7 |
|---|---|
| SMILES | CCOC1=CC(=CC=C1)S |
Product Overview
3-Ethoxybenzenethiol (CAS 86704-82-7), with molecular formula C8H10OS and molecular weight 154.05 g/mol. IUPAC: 3-ethoxybenzenethiol.
Chemical Property Profile of 3-Ethoxybenzenethiol
Property Insights of 3-Ethoxybenzenethiol
The XLogP value of 2.374 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethoxybenzenethiol. With a topological polar surface area (TPSA) of 9.23 Ų, 3-Ethoxybenzenethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethoxybenzenethiol has 1 hydrogen bond donor(s) and 2 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-Ethoxybenzenethiol?
The CAS number of 3-Ethoxybenzenethiol is 86704-82-7.
What is the molecular formula of 3-Ethoxybenzenethiol?
The molecular formula of 3-Ethoxybenzenethiol is C8H10OS.
What is the molecular weight of 3-Ethoxybenzenethiol?
The molecular weight of 3-Ethoxybenzenethiol is 154.05 g/mol.
Where can I buy 3-Ethoxybenzenethiol?
You can request a quote for 3-Ethoxybenzenethiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethoxybenzenethiol?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethoxybenzenethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.