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Substance Name: Isononanoic acid, tetraester with 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)-1,3-propanediol tetrakis(2-ethylhexanoate)
RN: 68443-83-4
InChIKey: LUNNGCNXIJXZDO-UHFFFAOYSA-N

Molecular Formula

  • C83-H152-O18

Molecular Weight

  • 1438.1
 
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Names and Synonyms

Synonyms

  • EINECS 270-559-5
  • Tripentaerythritol tetraisononanoate tetra-2-ethylhexanoate
  • Tripentaerythritol, tetraisononanoate, tetra-2-ethylhexanoate

Systematic Names

  • Isononanoic acid, tetraester with 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)-1,3-propanediol tetrakis(2-ethylhexanoate)
  • Tetraisononanoic acid, tetraester with 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)propane-1,3-diol tetrakis(2-ethylhexanoate)

Registry Numbers

CAS Registry Number

  • 68443-83-4

System Generated Number

  • 0068443834

Structure Descriptors

InChI

1S/C83H152O18/c1-17-25-45-69(21-5)77(88)98-61-82(62-99-78(89)70(22-6)46-26-18-2,59-96-75(86)51-39-31-35-43-67(13)14)55-92-53-81(57-94-73(84)49-37-29-33-41-65(9)10,58-95-74(85)50-38-30-34-42-66(11)12)54-93-56-83(63-100-79(90)71(23-7)47-27-19-3,64-101-80(91)72(24-8)48-28-20-4)60-97-76(87)52-40-32-36-44-68(15)16/h65-72H,17-64H2,1-16H3

InChIKey

LUNNGCNXIJXZDO-UHFFFAOYSA-N

Smiles

O(C(CCCCCC(C)C)=O)CC(COC([C@@H](CCCC)CC)=O)(COCC(COCC(COC(CCCCCC(C)C)=O)(COC([C@@H](CC)CCCC)=O)COC([C@@H](CCCC)CC)=O)(COC(CCCCCC(C)C)=O)COC(CCCCCC(C)C)=O)COC(=O)[C@@H](CC)CCCC