(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate
TL;DR: (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate (CAS 53950-58-6) is a chemical compound with molecular formula C36H70O2 and molecular weight 534.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl] hexadecanoate
Also Known As: codioester, Phytylpalmitat, phytyl palmitate, Codio ester, phytyl hexadecanoate
| Molecular Formula | C36H70O2 |
|---|---|
| Molecular Weight | 534.54 g/mol |
| LogP | 12.3963 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 28 |
| Exact Mass | 534.5376 |
| Heavy Atoms | 38 |
| Complexity | 535.4603 |
Chemical Identifiers
| CAS Number | 53950-58-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OC/C=C(\C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C |
Product Overview
(2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate (CAS 53950-58-6), with molecular formula C36H70O2 and molecular weight 534.54 g/mol. IUPAC: [(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-enyl] hexadecanoate.
Chemical Property Profile of (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate
Property Insights of (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate
The XLogP value of 12.3963 indicates that (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate 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 (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate?
The CAS number of (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate is 53950-58-6.
What is the molecular formula of (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate?
The molecular formula of (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate is C36H70O2.
What is the molecular weight of (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate?
The molecular weight of (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate is 534.54 g/mol.
Where can I buy (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate?
You can request a quote for (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate?
Yes, KEHONG BIO provides custom synthesis services for (2E,7R,11R)-3,7,11,15-tetramethyl-2-hexadecen-1-yl hexadecanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.