Squalene 2,3:22,23-Dioxide
TL;DR: Squalene 2,3:22,23-Dioxide (CAS 14031-39-1) is a chemical compound with molecular formula C30H50O2 and molecular weight 442.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane
Also Known As: 2,3,22,23-Dioxidosqualene, Squalene 2,3:22,23-Dioxide, 2,2'-(3,7,12,16-Tetramethyloctadeca-3,7,11,15-tetraene-1,18-diyl)bis(3,3-dimethyloxirane), 3-[(3E,7E,11E,15E)-18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane
| Molecular Formula | C30H50O2 |
|---|---|
| Molecular Weight | 442.38 g/mol |
| LogP | 9.0 |
| Topological Polar Surface Area | 25.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 442.38107 |
| Heavy Atoms | 32 |
| Complexity | 655.0 |
Chemical Identifiers
| CAS Number | 14031-39-1 |
|---|---|
| SMILES | CC(=CCCC=C(C)CCC=C(C)CCC1C(O1)(C)C)CCC=C(C)CCC2C(O2)(C)C |
| InChIKey | KABSNIWLJXCBGG-UHFFFAOYSA-N |
Product Overview
Squalene 2,3:22,23-Dioxide (CAS 14031-39-1), with molecular formula C30H50O2 and molecular weight 442.38 g/mol. IUPAC: 3-[18-(3,3-dimethyloxiran-2-yl)-3,7,12,16-tetramethyloctadeca-3,7,11,15-tetraenyl]-2,2-dimethyloxirane.
Chemical Property Profile of Squalene 2,3:22,23-Dioxide
Property Insights of Squalene 2,3:22,23-Dioxide
The XLogP value of 9.0 indicates that Squalene 2,3:22,23-Dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.1 Ų, Squalene 2,3:22,23-Dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Squalene 2,3:22,23-Dioxide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Squalene 2,3:22,23-Dioxide?
The CAS number of Squalene 2,3:22,23-Dioxide is 14031-39-1.
What is the molecular formula of Squalene 2,3:22,23-Dioxide?
The molecular formula of Squalene 2,3:22,23-Dioxide is C30H50O2.
What is the molecular weight of Squalene 2,3:22,23-Dioxide?
The molecular weight of Squalene 2,3:22,23-Dioxide is 442.38 g/mol.
Where can I buy Squalene 2,3:22,23-Dioxide?
You can request a quote for Squalene 2,3:22,23-Dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Squalene 2,3:22,23-Dioxide?
Yes, KEHONG BIO provides custom synthesis services for Squalene 2,3:22,23-Dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.