CAS Registry Number®
95193-76-3
CAS Name
Butanedioic acid, 2,3-bis(acetyloxy)-, [R-(R*,R*)]-, ester with 1,2,3-propanetriol (1:2), mixed diesters with palmitic acid and stearic acid
Molecular Formula
C18H36O2.C16H32O2.C8H10O8.C3H8O3
Other Names and Identifiers
InChI
InChI=1S/C18H36O2.C16H32O2.C8H10O8.C3H8O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;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);2-15H2,1H3,(H,17,18);5-6H,1-2H3,(H,11,12)(H,13,14);3-6H,1-2H2/t;;5-,6-;/m..1./s1
InChIKey
InChIKey=AHQFKUQMIJSKJF-BLUNCNMSSA-N
SMILES
[C@H]([C@@H](OC(C)=O)C(O)=O)(OC(C)=O)C(O)=O.C(CCCCCCCCCCC)CCCCCC(O)=O.C(CCCCCCCCCC)CCCCC(O)=O.C(CO)(CO)O
Canonical SMILES
O=C(O)CCCCCCCCCCCCCCC.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
- Butanedioic acid, 2,3-bis(acetyloxy)-, [R-(R*,R*)]-, ester with 1,2,3-propanetriol (1:2), mixed diesters with palmitic acid and stearic acid