Docosanoic acid, 1,1'-[2,2-bis(hydroxymethyl)-1,3-propanediyl] ester
[2-(docosanoyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] docosanoate
Also Known As: Pentaerythritol dibehenate|Pentaerythritol didocosanoate|EINECS 269-495-0|2,2-Bis(hydroxymethyl)propane-1,3-diyl didocosanoate|2,2-bis propane-1,3-diyldidocosanoate|Docosanoic acid, diester with pentaerythritol|Docosanoic acid, 2,2-bis(hydroxymethyl)-1,3-propanediyl ester|Docosanoic acid, 1,1'-(2,2-bis(hydroxymethyl)-1,3-propanediyl) ester|1,1'-[2,2-Bis(hydroxymethyl)-1,3-propanediyl] didocosanoate|Didocosanoic acid 2,2-bis(hydroxymethyl)-1,3-propanediyl ester|Docosanoic acid, 1,1'-[2,2-bis(hydroxymethyl)-1,3-propanediyl] ester|[2-(docosanoyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] docosanoate|2-[(DOCOSANOYLOXY)METHYL]-3-HYDROXY-2-(HYDROXYMETHYL)PROPYL DOCOSANOATE|269-495-0
| Molecular Formula | C49H96O6 |
|---|---|
| Molecular Weight | 780.7207 g/mol |
| LogP | 14.69 |
| Topological Polar Surface Area | 93.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 46 |
| Exact Mass | 780.7207 |
| Heavy Atoms | 55 |
| Complexity | 721.3 |
Chemical Identifiers
| CAS Number | 68258-72-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OCC(CO)(CO)COC(=O)CCCCCCCCCCCCCCCCCCCCC |
Product Overview
Docosanoic acid, 1,1'-[2,2-bis(hydroxymethyl)-1,3-propanediyl] ester (CAS 68258-72-0), with molecular formula C49H96O6 and molecular weight 780.7207 g/mol. IUPAC: [2-(docosanoyloxymethyl)-3-hydroxy-2-(hydroxymethyl)propyl] docosanoate.
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