alpha-Tocopheryl linoleate
TL;DR: alpha-Tocopheryl linoleate (CAS 51744-92-4) is a chemical compound with molecular formula C47H80O3 and molecular weight 692.61 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] octadeca-9,12-dienoate
Also Known As: alpha-Tocopheryl linoleate, D-alpha-Tocopherol linoleate, alpha-Tocopherol linoleate, d-, Linoleic acid, ester with alpha-Tocopherol, [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]chroman-6-yl] (9Z,12Z)-octadeca-9,12-dienoate
| Molecular Formula | C47H80O3 |
|---|---|
| Molecular Weight | 692.61 g/mol |
| LogP | 17.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 28 |
| Exact Mass | 692.6107 |
| Heavy Atoms | 50 |
| Complexity | 921.0 |
Chemical Identifiers
| CAS Number | 51744-92-4 |
|---|---|
| SMILES | CCCCCC=CCC=CCCCCCCCC(=O)OC1=C(C2=C(C(=C1C)C)O[C@](CC2)(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C |
| InChIKey | OFUHPGMOWVHNPN-NOQSEHCASA-N |
Product Overview
alpha-Tocopheryl linoleate (CAS 51744-92-4), with molecular formula C47H80O3 and molecular weight 692.61 g/mol. IUPAC: [(2R)-2,5,7,8-tetramethyl-2-[(4R,8R)-4,8,12-trimethyltridecyl]-3,4-dihydrochromen-6-yl] octadeca-9,12-dienoate.
Chemical Property Profile of alpha-Tocopheryl linoleate
Property Insights of alpha-Tocopheryl linoleate
The XLogP value of 17.6 indicates that alpha-Tocopheryl linoleate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, alpha-Tocopheryl linoleate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Tocopheryl linoleate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-Tocopheryl linoleate?
The CAS number of alpha-Tocopheryl linoleate is 51744-92-4.
What is the molecular formula of alpha-Tocopheryl linoleate?
The molecular formula of alpha-Tocopheryl linoleate is C47H80O3.
What is the molecular weight of alpha-Tocopheryl linoleate?
The molecular weight of alpha-Tocopheryl linoleate is 692.61 g/mol.
Where can I buy alpha-Tocopheryl linoleate?
You can request a quote for alpha-Tocopheryl linoleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Tocopheryl linoleate?
Yes, KEHONG BIO provides custom synthesis services for alpha-Tocopheryl linoleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.