Butanedioic acid, 2,3-bis(acetyloxy)-, ester with 1,2,3-propanetriol octadecanoate

84930-90-5

CAS Name

Butanedioic acid, 2,3-bis(acetyloxy)-, ester with 1,2,3-propanetriol octadecanoate

Molecular Formula

C₁₈H₃₆O₂.xC₈H₁₀O₈.xC₃H₈O₃

Other Names and Identifiers

InChI

InChI=1S/C18H36O2.C8H10O8.C3H8O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3(9)15-5(7(11)12)6(8(13)14)16-4(2)10;4-1-3(6)2-5/h2-17H2,1H3,(H,19,20);5-6H,1-2H3,(H,11,12)(H,13,14);3-6H,1-2H2/t;5-,6-;/m.1./s1

InChIKey

InChIKey=MJFFJEXWBORZLB-JGHXHLRYSA-N

SMILES

[C@H]([C@@H](OC(C)=O)C(O)=O)(OC(C)=O)C(O)=O.C(CCCCCCCCCCC)CCCCCC(O)=O.C(CO)(CO)O

Canonical SMILES

O=C(O)CCCCCCCCCCCCCCCCC.O=C(OC(C(=O)O)C(OC(=O)C)C(=O)O)C.OCC(O)CO

Other Names for this Substance

Deleted or Replaced CAS Registry Numbers

85186-50-1