1,3-Diacetyloxypropan-2-yl icosanoate
TL;DR: 1,3-Diacetyloxypropan-2-yl icosanoate (CAS 55429-68-0) is a chemical compound with molecular formula C27H50O6 and molecular weight 470.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-diacetyloxypropan-2-yl icosanoate
Also Known As: 1,3-diacetyloxypropan-2-yl icosanoate, icosanoicacid2-1-[methyl]ethylester, 1,3-Diacetoxy-2-propanyl icosanoate, Icosanoic acid 2-(acetyloxy)-1-[(acetyloxy)methyl]ethyl ester, 1,3-bis(acetyloxy)propan-2-yl icosanoate
| Molecular Formula | C27H50O6 |
|---|---|
| Molecular Weight | 470.36 g/mol |
| LogP | 9.5 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 26 |
| Exact Mass | 470.36075 |
| Heavy Atoms | 33 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 55429-68-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)C)COC(=O)C |
| InChIKey | LJFXWMKIYBPHON-UHFFFAOYSA-N |
Product Overview
1,3-Diacetyloxypropan-2-yl icosanoate (CAS 55429-68-0), with molecular formula C27H50O6 and molecular weight 470.36 g/mol. IUPAC: 1,3-diacetyloxypropan-2-yl icosanoate.
Chemical Property Profile of 1,3-Diacetyloxypropan-2-yl icosanoate
Property Insights of 1,3-Diacetyloxypropan-2-yl icosanoate
The XLogP value of 9.5 indicates that 1,3-Diacetyloxypropan-2-yl icosanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Diacetyloxypropan-2-yl icosanoate. Following Lipinski's Rule of Five, 1,3-Diacetyloxypropan-2-yl icosanoate has 0 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 1,3-Diacetyloxypropan-2-yl icosanoate?
The CAS number of 1,3-Diacetyloxypropan-2-yl icosanoate is 55429-68-0.
What is the molecular formula of 1,3-Diacetyloxypropan-2-yl icosanoate?
The molecular formula of 1,3-Diacetyloxypropan-2-yl icosanoate is C27H50O6.
What is the molecular weight of 1,3-Diacetyloxypropan-2-yl icosanoate?
The molecular weight of 1,3-Diacetyloxypropan-2-yl icosanoate is 470.36 g/mol.
Where can I buy 1,3-Diacetyloxypropan-2-yl icosanoate?
You can request a quote for 1,3-Diacetyloxypropan-2-yl icosanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Diacetyloxypropan-2-yl icosanoate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Diacetyloxypropan-2-yl icosanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.