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Substance Name: 1,2-Cyclohexanedicarboxylic acid, 1,1',1''-(1,2,3-propanetriyl) ester
RN: 68901-23-5
InChIKey: IZWUWCWNWYLTHQ-UHFFFAOYSA-N

Molecular Formula

  • C27-H38-O12

Molecular Weight

  • 554.585
 
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Names and Synonyms

Synonyms

  • EINECS 272-666-2
  • Glycerol tri(hexahydrophthalate)

Systematic Names

  • 1,2-Cyclohexanedicarboxylic acid, 1,1',1''-(1,2,3-propanetriyl) ester
  • 1,2-Cyclohexanedicarboxylic acid, 1,2,3-propanetriyl ester
  • Propane-1,2,3-triyl tris(cyclohexane-1,2-dicarboxylate)

Registry Numbers

CAS Registry Number

  • 68901-23-5

System Generated Number

  • 0068901235

Structure Descriptors

InChI

1S/C27H38O12/c28-22(29)16-7-1-4-10-19(16)25(34)37-13-15(39-27(36)21-12-6-3-9-18(21)24(32)33)14-38-26(35)20-11-5-2-8-17(20)23(30)31/h15-21H,1-14H2,(H,28,29)(H,30,31)(H,32,33)

InChIKey

IZWUWCWNWYLTHQ-UHFFFAOYSA-N

Smiles

O=C(OCC(OC(=O)[C@@H]1[C@@H](C(=O)O)CCCC1)COC(=O)[C@@H]1[C@@H](C(=O)O)CCCC1)[C@@H]1[C@@H](C(=O)O)CCCC1