Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

No inventory information available

Reference substance information

IUPAC name:
Fatty acids, C16-18, (even numbered) triesters with pentaerythritol

Molecular and structural information

Molecular formula:
C53H102O7 to C59H114O7
Molecular weight:
> 851 - < 936
SMILES notation:
O=C(OCC(COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)CCCCCCCCCCCCCCC
and
O=C(OCC(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC
InChl:
InChI=1S/C52H100O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-50(53)56-46-49(47-57-51(54)44-41-38-35-32-29-26-23-20-17-14-
and
InChI=1S/C58H112O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-56(59)62-52-55(53-63-57(60)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)5
Structural formula:
Chemical structure