Tocophersolan
TL;DR: Tocophersolan (CAS 9002-96-4) is a chemical compound with molecular formula C35H58O6 and molecular weight 574.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-O-(2-hydroxyethyl) 4-O-[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] butanedioate
Also Known As: Tocophersolan, Tocofersolan, Vitamin E TPGS, Tocofersolano, Tocofersolanum
| Molecular Formula | C35H58O6 |
|---|---|
| Molecular Weight | 574.42 g/mol |
| LogP | 9.9 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 20 |
| Exact Mass | 574.42334 |
| Heavy Atoms | 41 |
| Complexity | 768.0 |
Chemical Identifiers
| CAS Number | 9002-96-4 |
|---|---|
| SMILES | CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OC(=O)CCC(=O)OCCO)C |
| InChIKey | AOBORMOPSGHCAX-UHFFFAOYSA-N |
Product Overview
Tocophersolan (CAS 9002-96-4), with molecular formula C35H58O6 and molecular weight 574.42 g/mol. IUPAC: 1-O-(2-hydroxyethyl) 4-O-[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] butanedioate.
Chemical Property Profile of Tocophersolan
Property Insights of Tocophersolan
The XLogP value of 9.9 indicates that Tocophersolan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Tocophersolan. Following Lipinski's Rule of Five, Tocophersolan has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tocophersolan?
The CAS number of Tocophersolan is 9002-96-4.
What is the molecular formula of Tocophersolan?
The molecular formula of Tocophersolan is C35H58O6.
What is the molecular weight of Tocophersolan?
The molecular weight of Tocophersolan is 574.42 g/mol.
Where can I buy Tocophersolan?
You can request a quote for Tocophersolan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tocophersolan?
Yes, KEHONG BIO provides custom synthesis services for Tocophersolan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.