(E)-2-Butene-1-thiol
TL;DR: (E)-2-Butene-1-thiol (CAS 58688-79-2) is a chemical compound with molecular formula C4H8S and molecular weight 88.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-ene-1-thiol
Also Known As: crotyl mercaptan, 2-BUTENE-1-THIOL, (E)-but-2-ene-1-thiol, 2-Buten-1-thiol, (e)-2-butene-1-thiol
| Molecular Formula | C4H8S |
|---|---|
| Molecular Weight | 88.03 g/mol |
| LogP | 1.4923 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 88.03467 |
| Heavy Atoms | 5 |
| Complexity | 30.62919 |
Chemical Identifiers
| CAS Number | 58688-79-2 |
|---|---|
| SMILES | C/C=C/CS |
Product Overview
(E)-2-Butene-1-thiol (CAS 58688-79-2), with molecular formula C4H8S and molecular weight 88.03 g/mol. IUPAC: (E)-but-2-ene-1-thiol.
Chemical Property Profile of (E)-2-Butene-1-thiol
Property Insights of (E)-2-Butene-1-thiol
The XLogP value of 1.4923 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-Butene-1-thiol. With a topological polar surface area (TPSA) of 0.0 Ų, (E)-2-Butene-1-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-2-Butene-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 (E)-2-Butene-1-thiol?
The CAS number of (E)-2-Butene-1-thiol is 58688-79-2.
What is the molecular formula of (E)-2-Butene-1-thiol?
The molecular formula of (E)-2-Butene-1-thiol is C4H8S.
What is the molecular weight of (E)-2-Butene-1-thiol?
The molecular weight of (E)-2-Butene-1-thiol is 88.03 g/mol.
Where can I buy (E)-2-Butene-1-thiol?
You can request a quote for (E)-2-Butene-1-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-Butene-1-thiol?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-Butene-1-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.