2-((1-Methylpropyl)sulfinyl)butane
TL;DR: 2-((1-Methylpropyl)sulfinyl)butane (CAS 13153-06-5) is a chemical compound with molecular formula C8H18OS and molecular weight 162.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butan-2-ylsulfinylbutane
Also Known As: sec-Butyl sulfoxide, di-sec-butyl sulfoxide, Di-isobutyl sulfoxide, Sulfoxide, isobutyl, Diisobutyl sulphoxide
| Molecular Formula | C8H18OS |
|---|---|
| Molecular Weight | 162.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 162.10783 |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 13153-06-5 |
|---|---|
| SMILES | CCC(C)S(=O)C(C)CC |
| InChIKey | PARCUCWFQOWGFX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((1-Methylpropyl)sulfinyl)butane (CAS 13153-06-5), with molecular formula C8H18OS and molecular weight 162.11 g/mol. IUPAC: 2-butan-2-ylsulfinylbutane.
Chemical Property Profile of 2-((1-Methylpropyl)sulfinyl)butane
Property Insights of 2-((1-Methylpropyl)sulfinyl)butane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((1-Methylpropyl)sulfinyl)butane. With a topological polar surface area (TPSA) of 36.3 Ų, 2-((1-Methylpropyl)sulfinyl)butane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((1-Methylpropyl)sulfinyl)butane 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 2-((1-Methylpropyl)sulfinyl)butane?
The CAS number of 2-((1-Methylpropyl)sulfinyl)butane is 13153-06-5.
What is the molecular formula of 2-((1-Methylpropyl)sulfinyl)butane?
The molecular formula of 2-((1-Methylpropyl)sulfinyl)butane is C8H18OS.
What is the molecular weight of 2-((1-Methylpropyl)sulfinyl)butane?
The molecular weight of 2-((1-Methylpropyl)sulfinyl)butane is 162.11 g/mol.
Where can I buy 2-((1-Methylpropyl)sulfinyl)butane?
You can request a quote for 2-((1-Methylpropyl)sulfinyl)butane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((1-Methylpropyl)sulfinyl)butane?
Yes, KEHONG BIO provides custom synthesis services for 2-((1-Methylpropyl)sulfinyl)butane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.