sec-Butyl ethyl sulfoxide
TL;DR: sec-Butyl ethyl sulfoxide (CAS 7694-18-0) 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.
2-ethylsulfinylbutane
Also Known As: sec-Butyl ethyl sulfoxide, 2-ethanesulfinyl-butane, 2-ethylsulfinylbutane, 2-(Ethylsulfinyl)butane, 2-(ethanesulfinyl)butane
| Molecular Formula | C6H14OS |
|---|---|
| Molecular Weight | 134.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 134.07654 |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
Chemical Identifiers
| CAS Number | 7694-18-0 |
|---|---|
| SMILES | CCC(C)S(=O)CC |
| InChIKey | LEWXGMHZJYIGGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
sec-Butyl ethyl sulfoxide (CAS 7694-18-0), with molecular formula C6H14OS and molecular weight 134.08 g/mol. IUPAC: 2-ethylsulfinylbutane.
Chemical Property Profile of sec-Butyl ethyl sulfoxide
Property Insights of sec-Butyl ethyl sulfoxide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for sec-Butyl ethyl sulfoxide. With a topological polar surface area (TPSA) of 36.3 Ų, sec-Butyl ethyl sulfoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, sec-Butyl ethyl sulfoxide has 0 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 sec-Butyl ethyl sulfoxide?
The CAS number of sec-Butyl ethyl sulfoxide is 7694-18-0.
What is the molecular formula of sec-Butyl ethyl sulfoxide?
The molecular formula of sec-Butyl ethyl sulfoxide is C6H14OS.
What is the molecular weight of sec-Butyl ethyl sulfoxide?
The molecular weight of sec-Butyl ethyl sulfoxide is 134.08 g/mol.
Where can I buy sec-Butyl ethyl sulfoxide?
You can request a quote for sec-Butyl ethyl sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for sec-Butyl ethyl sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for sec-Butyl ethyl sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.