Hexyl sulfoxide
TL;DR: Hexyl sulfoxide (CAS 2180-20-3) is a chemical compound with molecular formula C12H26OS and molecular weight 218.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-hexylsulfinylhexane
Also Known As: Dihexyl sulfoxide, HEXYL SULFOXIDE, Di-n-hexyl sulfoxide, hexylsulfoxide, dihexylsulphoxide
| Molecular Formula | C12H26OS |
|---|---|
| Molecular Weight | 218.17 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 218.17044 |
| Heavy Atoms | 14 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 2180-20-3 |
|---|---|
| SMILES | CCCCCCS(=O)CCCCCC |
| InChIKey | DLEXINLCPPEMMI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexyl sulfoxide (CAS 2180-20-3), with molecular formula C12H26OS and molecular weight 218.17 g/mol. IUPAC: 1-hexylsulfinylhexane.
Chemical Property Profile of Hexyl sulfoxide
Property Insights of Hexyl sulfoxide
The XLogP value of 3.9 indicates that Hexyl sulfoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.3 Ų, Hexyl sulfoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexyl 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 Hexyl sulfoxide?
The CAS number of Hexyl sulfoxide is 2180-20-3.
What is the molecular formula of Hexyl sulfoxide?
The molecular formula of Hexyl sulfoxide is C12H26OS.
What is the molecular weight of Hexyl sulfoxide?
The molecular weight of Hexyl sulfoxide is 218.17 g/mol.
Where can I buy Hexyl sulfoxide?
You can request a quote for Hexyl sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexyl sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for Hexyl sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.