CAS 1246833-66-8

1-(Chloromethyl-d2)-2-[(1-oxohexadecyl)oxy]ethyl-1,2,2-d3 9,12-octadecadienoate

Description:

1-(Chloromethyl-d2)-2-[(1-oxohexadecyl)oxy]ethyl-1,2,2-d3 9,12-octadecadienoate is a synthetic chemical compound characterized by its complex structure, which includes a chloromethyl group, a hexadecyl chain, and a diene moiety. The presence of deuterium isotopes (d2 and d3) indicates that this compound is isotopically labeled, which is often used in research to trace metabolic pathways or in NMR spectroscopy for structural analysis. The compound features an ester functional group, which suggests it may exhibit properties typical of fatty acid derivatives, such as hydrophobicity and potential biological activity. Its long hydrocarbon chain contributes to its lipophilicity, making it soluble in organic solvents but less so in water. The specific arrangement of double bonds in the octadecadienoate portion implies potential reactivity and interactions with biological membranes. Overall, this compound may be of interest in biochemical research, particularly in studies involving lipid metabolism or drug delivery systems.

Formula: C₃₇H₆₂ClD₅O₄

InChI: InChI=1S/C37H67ClO4/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(40)42-35(33-38)34-41-36(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h11,13,17-18,35H,3-10,12,14-16,19-34H2,1-2H3/i33D2,34D2,35D

InChI key: InChIKey=KBIIPAPVKFNOGB-WJZUKHFDSA-N

SMILES: C(OC(CCCCCCCC=CCC=CCCCCC)=O)(C(OC(CCCCCCCCCCCCCCC)=O)([2H])[2H])(C(Cl)([2H])[2H])[2H]

Synonyms:

• 1-(Chloromethyl-d2)-2-[(1-oxohexadecyl)oxy]ethyl-1,2,2-d3 9,12-octadecadienoate
• 9,12-Octadecadienoic acid, 1-(chloromethyl-d2)-2-[(1-oxohexadecyl)oxy]ethyl-1,2,2-d3 ester

rac-1-Palmitoyl-2-linoleoyl-3-chloropropanediol-d5

Controlled Product

CAS: 1246833-66-8

Applications Labelled lipids. New lipids in food protein hydrolyzates.

Formula: C₃₇H₆₂D₅ClO₄

Purity: >85%

Color and Shape: Neat

Molecular weight: 616.41

Ref: TR-P158952