Butyl ethyl sulfide
TL;DR: Butyl ethyl sulfide (CAS 638-46-0) is a chemical compound with molecular formula C6H14S and molecular weight 118.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylsulfanylbutane
Also Known As: n-Butyl Ethyl Sulfide, Butyl ethyl sulfide, 3-Thiaheptane, 1-ethylsulfanylbutane, Ethyl butyl sulfide
| Molecular Formula | C6H14S |
|---|---|
| Molecular Weight | 118.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 118.08162 |
| Heavy Atoms | 7 |
| Complexity | 27.0 |
Chemical Identifiers
| CAS Number | 638-46-0 |
|---|---|
| SMILES | CCCCSCC |
| InChIKey | XJIRSLHMKBUGMR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl ethyl sulfide (CAS 638-46-0), with molecular formula C6H14S and molecular weight 118.08 g/mol. IUPAC: 1-ethylsulfanylbutane.
Chemical Property Profile of Butyl ethyl sulfide
Property Insights of Butyl ethyl sulfide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl ethyl sulfide. With a topological polar surface area (TPSA) of 25.3 Ų, Butyl ethyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl ethyl sulfide 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 Butyl ethyl sulfide?
The CAS number of Butyl ethyl sulfide is 638-46-0.
What is the molecular formula of Butyl ethyl sulfide?
The molecular formula of Butyl ethyl sulfide is C6H14S.
What is the molecular weight of Butyl ethyl sulfide?
The molecular weight of Butyl ethyl sulfide is 118.08 g/mol.
Where can I buy Butyl ethyl sulfide?
You can request a quote for Butyl ethyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl ethyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for Butyl ethyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.