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Substance Name: Octanoic acid, 3-oxo-, 1,1',1''-(1,2,3-propanetriyl) ester
RN: 68444-14-4
InChIKey: DNBRLNRCKKEJHW-UHFFFAOYSA-N

Molecular Formula

  • C27-H44-O9

Molecular Weight

  • 512.636
 
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Names and Synonyms

Synonyms

  • EINECS 270-586-2
  • Glycerol tri(3-oxooctanoate)
  • Glyceryl tri(3-oxooctanoate)

Systematic Names

  • Octanoic acid, 3-oxo-, 1,1',1''-(1,2,3-propanetriyl) ester
  • Octanoic acid, 3-oxo-, 1,2,3-propanetriyl ester
  • Propane-1,2,3-triyl tris(3-oxooctanoate)

Registry Numbers

CAS Registry Number

  • 68444-14-4

System Generated Number

  • 0068444144

Structure Descriptors

InChI

1S/C27H44O9/c1-4-7-10-13-21(28)16-25(31)34-19-24(36-27(33)18-23(30)15-12-9-6-3)20-35-26(32)17-22(29)14-11-8-5-2/h24H,4-20H2,1-3H3

InChIKey

DNBRLNRCKKEJHW-UHFFFAOYSA-N

Smiles

O=C(OCC(OC(=O)CC(=O)CCCCC)COC(=O)CC(=O)CCCCC)CC(=O)CCCCC