1-(cis-13-Docosenoyl)-rac-glycerol
TL;DR: 1-(cis-13-Docosenoyl)-rac-glycerol (CAS 5389-95-7) is a chemical compound with molecular formula C25H48O4 and molecular weight 412.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dihydroxypropyl docos-13-enoate
Also Known As: Monoerucin, Glyceryl erucate, 1-(cis-13-Docosenoyl)-rac-glycerol, 2,3-dihydroxypropyl docos-13-enoate, 2,3-Dihydroxypropyl (13Z)-13-docosenoate
| Molecular Formula | C25H48O4 |
|---|---|
| Molecular Weight | 412.36 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 23 |
| Exact Mass | 412.35526 |
| Heavy Atoms | 29 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 5389-95-7 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCCCCC(=O)OCC(CO)O |
| InChIKey | ZXNAIPHYBVMMPY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(cis-13-Docosenoyl)-rac-glycerol (CAS 5389-95-7), with molecular formula C25H48O4 and molecular weight 412.36 g/mol. IUPAC: 2,3-dihydroxypropyl docos-13-enoate.
Chemical Property Profile of 1-(cis-13-Docosenoyl)-rac-glycerol
Property Insights of 1-(cis-13-Docosenoyl)-rac-glycerol
The XLogP value of 8.6 indicates that 1-(cis-13-Docosenoyl)-rac-glycerol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(cis-13-Docosenoyl)-rac-glycerol. Following Lipinski's Rule of Five, 1-(cis-13-Docosenoyl)-rac-glycerol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(cis-13-Docosenoyl)-rac-glycerol?
The CAS number of 1-(cis-13-Docosenoyl)-rac-glycerol is 5389-95-7.
What is the molecular formula of 1-(cis-13-Docosenoyl)-rac-glycerol?
The molecular formula of 1-(cis-13-Docosenoyl)-rac-glycerol is C25H48O4.
What is the molecular weight of 1-(cis-13-Docosenoyl)-rac-glycerol?
The molecular weight of 1-(cis-13-Docosenoyl)-rac-glycerol is 412.36 g/mol.
Where can I buy 1-(cis-13-Docosenoyl)-rac-glycerol?
You can request a quote for 1-(cis-13-Docosenoyl)-rac-glycerol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(cis-13-Docosenoyl)-rac-glycerol?
Yes, KEHONG BIO provides custom synthesis services for 1-(cis-13-Docosenoyl)-rac-glycerol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.