1-Butene, 3-(butylthio)-
TL;DR: 1-Butene, 3-(butylthio)- (CAS 689-90-7) is a chemical compound with molecular formula C8H16S and molecular weight 144.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-but-3-en-2-ylsulfanylbutane
Also Known As: 1-Butene, 3-(butylthio)-, 1-but-3-en-2-ylsulfanylbutane, 3-(Butylsulfanyl)-1-butene #, 3-(BUTYLSULFANYL)BUT-1-ENE
| Molecular Formula | C8H16S |
|---|---|
| Molecular Weight | 144.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 144.09727 |
| Heavy Atoms | 9 |
| Complexity | 69.0 |
Chemical Identifiers
| CAS Number | 689-90-7 |
|---|---|
| SMILES | CCCCSC(C)C=C |
| InChIKey | CTKCXSPYEYWRJT-UHFFFAOYSA-N |
Product Overview
1-Butene, 3-(butylthio)- (CAS 689-90-7), with molecular formula C8H16S and molecular weight 144.10 g/mol. IUPAC: 1-but-3-en-2-ylsulfanylbutane.
Chemical Property Profile of 1-Butene, 3-(butylthio)-
Property Insights of 1-Butene, 3-(butylthio)-
The XLogP value of 3.2 indicates that 1-Butene, 3-(butylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, 1-Butene, 3-(butylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butene, 3-(butylthio)- has 0 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 1-Butene, 3-(butylthio)-?
The CAS number of 1-Butene, 3-(butylthio)- is 689-90-7.
What is the molecular formula of 1-Butene, 3-(butylthio)-?
The molecular formula of 1-Butene, 3-(butylthio)- is C8H16S.
What is the molecular weight of 1-Butene, 3-(butylthio)-?
The molecular weight of 1-Butene, 3-(butylthio)- is 144.10 g/mol.
Where can I buy 1-Butene, 3-(butylthio)-?
You can request a quote for 1-Butene, 3-(butylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butene, 3-(butylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butene, 3-(butylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.