Docos-13-enyl docos-13-enoate
TL;DR: Docos-13-enyl docos-13-enoate (CAS 84605-12-9) is a chemical compound with molecular formula C44H84O2 and molecular weight 644.65 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-docos-13-enyl] (E)-docos-13-enoate
Also Known As: brassidyl brassidate, Docos-13-enyl docos-13-enoate, EINECS 283-389-1, 13-Docosenyl 13-docosenoate, Docos-13-en-1-yl docos-13-enoate
| Molecular Formula | C44H84O2 |
|---|---|
| Molecular Weight | 644.65 g/mol |
| LogP | 15.7254 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 39 |
| Exact Mass | 644.64716 |
| Heavy Atoms | 46 |
| Complexity | 621.3967 |
Chemical Identifiers
| CAS Number | 84605-12-9 |
|---|---|
| SMILES | CCCCCCCC/C=C/CCCCCCCCCCCCOC(=O)CCCCCCCCCCC/C=C/CCCCCCCC |
Product Overview
Docos-13-enyl docos-13-enoate (CAS 84605-12-9), with molecular formula C44H84O2 and molecular weight 644.65 g/mol. IUPAC: [(E)-docos-13-enyl] (E)-docos-13-enoate.
Chemical Property Profile of Docos-13-enyl docos-13-enoate
Property Insights of Docos-13-enyl docos-13-enoate
The XLogP value of 15.7254 indicates that Docos-13-enyl docos-13-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Docos-13-enyl docos-13-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Docos-13-enyl docos-13-enoate 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 Docos-13-enyl docos-13-enoate?
The CAS number of Docos-13-enyl docos-13-enoate is 84605-12-9.
What is the molecular formula of Docos-13-enyl docos-13-enoate?
The molecular formula of Docos-13-enyl docos-13-enoate is C44H84O2.
What is the molecular weight of Docos-13-enyl docos-13-enoate?
The molecular weight of Docos-13-enyl docos-13-enoate is 644.65 g/mol.
Where can I buy Docos-13-enyl docos-13-enoate?
You can request a quote for Docos-13-enyl docos-13-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Docos-13-enyl docos-13-enoate?
Yes, KEHONG BIO provides custom synthesis services for Docos-13-enyl docos-13-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.