2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate
TL;DR: 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate (CAS 54381-53-2) is a chemical compound with molecular formula C33H64O6 and molecular weight 556.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,2-bis(hydroxymethyl)-3-tetradecanoyloxypropyl] tetradecanoate
Also Known As: pentaerythritol dimyristate, EINECS 259-135-0, Pentaerythritol ditetradecanoate, 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate, [2,2-bis(hydroxymethyl)-3-tetradecanoyloxypropyl] tetradecanoate
| Molecular Formula | C33H64O6 |
|---|---|
| Molecular Weight | 556.47 g/mol |
| LogP | 8.446 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 30 |
| Exact Mass | 556.4703 |
| Heavy Atoms | 39 |
| Complexity | 502.31232 |
Chemical Identifiers
| CAS Number | 54381-53-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCC(=O)OCC(CO)(CO)COC(=O)CCCCCCCCCCCCC |
Product Overview
2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate (CAS 54381-53-2), with molecular formula C33H64O6 and molecular weight 556.47 g/mol. IUPAC: [2,2-bis(hydroxymethyl)-3-tetradecanoyloxypropyl] tetradecanoate.
Chemical Property Profile of 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate
Property Insights of 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate
The XLogP value of 8.446 indicates that 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate. Following Lipinski's Rule of Five, 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate has 2 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 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate?
The CAS number of 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate is 54381-53-2.
What is the molecular formula of 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate?
The molecular formula of 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate is C33H64O6.
What is the molecular weight of 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate?
The molecular weight of 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate is 556.47 g/mol.
Where can I buy 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate?
You can request a quote for 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Bis(hydroxymethyl)propane-1,3-diyl dimyristate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.