(9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate)
TL;DR: (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) (CAS 68966-40-5) is a chemical compound with molecular formula C77H144O8 and molecular weight 1197.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(octadecanoyloxymethyl)-3-octadec-9-enoyloxy-2-(octadec-9-enoyloxymethyl)propyl] octadecanoate
Also Known As: Pentaerythritol dioleate distearate, 2,2-bis[[oxy]methyl]-1,3-propanediyldioleate, 2,2-BIS[[(1-OXOOCTADECYL)OXY]METHYL]-1,3-PROPANEDIYL DIOLEATE, (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate), 9-Octadecenoic acid (9Z)-, 2,2-bis(((1-oxooctadecyl)oxy)methyl)-1,3-propanediyl ester
| Molecular Formula | C77H144O8 |
|---|---|
| Molecular Weight | 1197.09 g/mol |
| LogP | 31.7 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 74 |
| Exact Mass | 1197.0862 |
| Heavy Atoms | 85 |
| Complexity | 1360.0 |
Chemical Identifiers
| CAS Number | 68966-40-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCC=CCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCCC |
| InChIKey | JWIGOZQHOZXYPI-UHFFFAOYSA-N |
Product Overview
(9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) (CAS 68966-40-5), with molecular formula C77H144O8 and molecular weight 1197.09 g/mol. IUPAC: [2-(octadecanoyloxymethyl)-3-octadec-9-enoyloxy-2-(octadec-9-enoyloxymethyl)propyl] octadecanoate.
Chemical Property Profile of (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate)
Property Insights of (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate)
The XLogP value of 31.7 indicates that (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate). Following Lipinski's Rule of Five, (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate)?
The CAS number of (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) is 68966-40-5.
What is the molecular formula of (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate)?
The molecular formula of (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) is C77H144O8.
What is the molecular weight of (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate)?
The molecular weight of (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) is 1197.09 g/mol.
Where can I buy (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate)?
You can request a quote for (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate)?
Yes, KEHONG BIO provides custom synthesis services for (9Z,9'Z)-2,2-Bis((stearoyloxy)methyl)propane-1,3-diyl bis(octadec-9-enoate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.