Trihydroxystearin

CAS Registry Number®

139-44-6

CAS Name

Trihydroxystearin

Molecular Formula

C57H110O9

Molecular Mass

939.48

Cite this Page

Trihydroxystearin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=139-44-6 (retrieved 2024-11-21) (CAS RN: 139-44-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    89.4 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C57H110O9/c1-4-7-10-31-40-51(58)43-34-25-19-13-16-22-28-37-46-55(61)64-49-54(66-57(63)48-39-30-24-18-15-21-27-36-45-53(60)42-33-12-9-6-3)50-65-56(62)47-38-29-23-17-14-20-26-35-44-52(59)41-32-11-8-5-2/h51-54,58-60H,4-50H2,1-3H3

InChIKey

InChIKey=WCOXQTXVACYMLM-UHFFFAOYSA-N

SMILES

C(OC(CCCCCCCCCCC(CCCCCC)O)=O)(COC(CCCCCCCCCCC(CCCCCC)O)=O)COC(CCCCCCCCCCC(CCCCCC)O)=O

Canonical SMILES

O=C(OCC(OC(=O)CCCCCCCCCCC(O)CCCCCC)COC(=O)CCCCCCCCCCC(O)CCCCCC)CCCCCCCCCCC(O)CCCCCC

Other Names for this Substance

  • Octadecanoic acid, 12-hydroxy-, 1,1′,1′′-(1,2,3-propanetriyl) ester
  • Octadecanoic acid, 12-hydroxy-, 1,2,3-propanetriyl ester
  • Octadecanoic acid, 12-hydroxy-, triester with glycerol
  • Glycerol, tris(12-hydroxyoctadecanoate)
  • Glyceryl tris(12-hydroxystearate)

View All

Deleted or Replaced CAS Registry Numbers

38264-86-7, 117313-82-3, 194498-31-2, 400628-60-6, 1280568-87-7

CAS INSIGHTSTM
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