CAS 502-52-3|3-(hexadecanoyloxy)-2-hydroxypropyl hexadecanoate|Glyceryl 1,3-dipalmitate|1,3-Dihexa-decanoyl-rac-glycerol|3-(hexadecanoyloxy)-2-hydroxypropyl hexadecanoate|1,3-DIPALMITOYLGLYCEROL|1,3...

General Information

Structure

Molecular Formula

C₃₅H₆₈O₅

Molecular Mass

568.91142

Exact Mass

568.50667528

Charge

InChI

InChI=1S/C35H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-31-33(36)32-40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36H,3-32H2,1-2H3

InChIKey

GFAZGHREJPXDMH-UHFFFAOYSA-N

Canonic Smiles

CCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCC)O

Isomeric Smiles

CCCCCCCCCCCCCCCC(=O)OCC(O)COC(=O)CCCCCCCCCCCCCCC

Calculated Properties

JChem

LogD (pH = 7.4)

12.00

LogD (pH = 5.5)

12.00

Log P

12.00

Rotatable Bonds

H Donor

H Acceptors

Lipinski's Rule of Five

false

Acid pKa

13.63

Polar Surface Area

72.83

Polarizability

76.28

Molar Refractivity

167.70

LOG S

-13.36

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

IUPAC Traditional name

3-(hexadecanoyloxy)-2-hydroxypropyl hexadecanoate glyceryl dipalmitate

Synonyms

Glyceryl 1,3-dipalmitate1,3-Dihexa-decanoyl-rac-glycerol1,3-DIPALMITOYLGLYCEROL1,3-Dipalmitin2-hydroxypropane-1,3-diyl dipalmitate1,3-Dihexadecanoylglycerol1,3-Dipalmitoyl-glycerolGlyceryl 1,3-dipalmitateα,γ-Dipalmitin1,3-di(hexadecanoyloxy)-2-propanolDiacylglycerol(16:0/0:0/16:0)DG(16:0/0:0/16:0)1,3-dihexadecanoylglycerol1,3-dipalmitin1,3-dipalmitoylglycerolGlyceryl 1,3-dipalmitateDAG(16:0/0:0/16:0)Diacylglycerol(32:0)DAG(32:0)DG(32:0)2-Hydroxypropane-1,3-diyl dipalmitate

IUPAC name

3-(hexadecanoyloxy)-2-hydroxypropyl hexadecanoate

Names and Identifiers

Registration numbers

CAS Number

EC Number

Beilstein Number

MDL Number