2-(Cyclohex-3-en-1-yl)ethane-1-thiol
TL;DR: 2-(Cyclohex-3-en-1-yl)ethane-1-thiol (CAS 71859-81-9) is a chemical compound with molecular formula C8H14S and molecular weight 142.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclohex-3-en-1-ylethanethiol
Also Known As: 2-cyclohex-3-en-1-ylethanethiol, 2-(cyclohex-3-en-1-yl)ethanethiol, 2-Cyclohex-3-enyl-aethanthiol, 2-(cyclohex-3-en-1-yl)ethane-1-thiol
| Molecular Formula | C8H14S |
|---|---|
| Molecular Weight | 142.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 1.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 142.08162 |
| Heavy Atoms | 9 |
| Complexity | 96.0 |
Chemical Identifiers
| CAS Number | 71859-81-9 |
|---|---|
| SMILES | C1CC(CC=C1)CCS |
| InChIKey | OFADWQHBIIMCMX-UHFFFAOYSA-N |
Product Overview
2-(Cyclohex-3-en-1-yl)ethane-1-thiol (CAS 71859-81-9), with molecular formula C8H14S and molecular weight 142.08 g/mol. IUPAC: 2-cyclohex-3-en-1-ylethanethiol.
Chemical Property Profile of 2-(Cyclohex-3-en-1-yl)ethane-1-thiol
Property Insights of 2-(Cyclohex-3-en-1-yl)ethane-1-thiol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Cyclohex-3-en-1-yl)ethane-1-thiol. With a topological polar surface area (TPSA) of 1.0 Ų, 2-(Cyclohex-3-en-1-yl)ethane-1-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Cyclohex-3-en-1-yl)ethane-1-thiol has 1 hydrogen bond donor(s) and 1 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-(Cyclohex-3-en-1-yl)ethane-1-thiol?
The CAS number of 2-(Cyclohex-3-en-1-yl)ethane-1-thiol is 71859-81-9.
What is the molecular formula of 2-(Cyclohex-3-en-1-yl)ethane-1-thiol?
The molecular formula of 2-(Cyclohex-3-en-1-yl)ethane-1-thiol is C8H14S.
What is the molecular weight of 2-(Cyclohex-3-en-1-yl)ethane-1-thiol?
The molecular weight of 2-(Cyclohex-3-en-1-yl)ethane-1-thiol is 142.08 g/mol.
Where can I buy 2-(Cyclohex-3-en-1-yl)ethane-1-thiol?
You can request a quote for 2-(Cyclohex-3-en-1-yl)ethane-1-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Cyclohex-3-en-1-yl)ethane-1-thiol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Cyclohex-3-en-1-yl)ethane-1-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.