1-Butanol, 4-(ethylthio)-
TL;DR: 1-Butanol, 4-(ethylthio)- (CAS 1880-36-0) is a chemical compound with molecular formula C6H14OS and molecular weight 134.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethylsulfanylbutan-1-ol
Also Known As: 1-butanol, 4-(ethylthio)-, 4-(ethylsulfanyl)butan-1-ol, 4-ethylsulfanylbutan-1-ol, 4-ethylthio-1-butanol, 4-ethylthiobutan-1-ol
| Molecular Formula | C6H14OS |
|---|---|
| Molecular Weight | 134.08 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 134.07654 |
| Heavy Atoms | 8 |
| Complexity | 39.0 |
Chemical Identifiers
| CAS Number | 1880-36-0 |
|---|---|
| SMILES | CCSCCCCO |
| InChIKey | XEIZVCOAFMXFCO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Butanol, 4-(ethylthio)- (CAS 1880-36-0), with molecular formula C6H14OS and molecular weight 134.08 g/mol. IUPAC: 4-ethylsulfanylbutan-1-ol.
Chemical Property Profile of 1-Butanol, 4-(ethylthio)-
Property Insights of 1-Butanol, 4-(ethylthio)-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butanol, 4-(ethylthio)-. With a topological polar surface area (TPSA) of 45.5 Ų, 1-Butanol, 4-(ethylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanol, 4-(ethylthio)- 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 1-Butanol, 4-(ethylthio)-?
The CAS number of 1-Butanol, 4-(ethylthio)- is 1880-36-0.
What is the molecular formula of 1-Butanol, 4-(ethylthio)-?
The molecular formula of 1-Butanol, 4-(ethylthio)- is C6H14OS.
What is the molecular weight of 1-Butanol, 4-(ethylthio)-?
The molecular weight of 1-Butanol, 4-(ethylthio)- is 134.08 g/mol.
Where can I buy 1-Butanol, 4-(ethylthio)-?
You can request a quote for 1-Butanol, 4-(ethylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanol, 4-(ethylthio)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanol, 4-(ethylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.