Butane, 1-(ethylsulfinyl)-
TL;DR: Butane, 1-(ethylsulfinyl)- (CAS 2976-99-0) 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.
1-ethylsulfinylbutane
Also Known As: Butane, 1-(ethylsulfinyl)-, Sulfoxide, butyl ethyl, 1-ethylsulfinylbutane, Butyl ethyl sulfoxide, ethylbutylsulfoxide
| 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 | 4 |
| Exact Mass | 134.07654 |
| Heavy Atoms | 8 |
| Complexity | 70.0 |
Chemical Identifiers
| CAS Number | 2976-99-0 |
|---|---|
| SMILES | CCCCS(=O)CC |
| InChIKey | CYDQHOZLSSXJKU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butane, 1-(ethylsulfinyl)- (CAS 2976-99-0), with molecular formula C6H14OS and molecular weight 134.08 g/mol. IUPAC: 1-ethylsulfinylbutane.
Chemical Property Profile of Butane, 1-(ethylsulfinyl)-
Property Insights of Butane, 1-(ethylsulfinyl)-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 1-(ethylsulfinyl)-. With a topological polar surface area (TPSA) of 36.3 Ų, Butane, 1-(ethylsulfinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 1-(ethylsulfinyl)- 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 Butane, 1-(ethylsulfinyl)-?
The CAS number of Butane, 1-(ethylsulfinyl)- is 2976-99-0.
What is the molecular formula of Butane, 1-(ethylsulfinyl)-?
The molecular formula of Butane, 1-(ethylsulfinyl)- is C6H14OS.
What is the molecular weight of Butane, 1-(ethylsulfinyl)-?
The molecular weight of Butane, 1-(ethylsulfinyl)- is 134.08 g/mol.
Where can I buy Butane, 1-(ethylsulfinyl)-?
You can request a quote for Butane, 1-(ethylsulfinyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butane, 1-(ethylsulfinyl)-?
Yes, KEHONG BIO provides custom synthesis services for Butane, 1-(ethylsulfinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.