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Details

Stereochemistry ACHIRAL
Molecular Formula C37H68O8
Molecular Weight 640.931
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PENTAERYTHRITYL TETRACAPRYLATE

SMILES

CCCCCCCC(=O)OCC(COC(=O)CCCCCCC)(COC(=O)CCCCCCC)COC(=O)CCCCCCC

InChI

InChIKey=CFRNDJFRRKMHTL-UHFFFAOYSA-N
InChI=1S/C37H68O8/c1-5-9-13-17-21-25-33(38)42-29-37(30-43-34(39)26-22-18-14-10-6-2,31-44-35(40)27-23-19-15-11-7-3)32-45-36(41)28-24-20-16-12-8-4/h5-32H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C37H68O8
Molecular Weight 640.931
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 21:13:32 GMT 2023
Edited
by admin
on Fri Dec 15 21:13:32 GMT 2023
Record UNII
8CW55ZFK6U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENTAERYTHRITYL TETRACAPRYLATE
Common Name English
2,2-BIS(((1-OXOOCTYL)OXY)METHYL)-1,3-PROPANEDIYL DIOCTANOATE
Systematic Name English
OCTANOIC ACID, 1,1'-(2,2-BIS(((1-OXOOCTYL)OXY)METHYL)-1,3-PROPANEDIYL) ESTER
Common Name English
PENTAERYTHRITOL TETRACAPRYLATE
Systematic Name English
OCTANOIC ACID, 2,2-BIS(((1-OXOOCTYL)OXY)METHYL)-1,3-PROPANEDIYL ESTER
Common Name English
Code System Code Type Description
FDA UNII
8CW55ZFK6U
Created by admin on Fri Dec 15 21:13:32 GMT 2023 , Edited by admin on Fri Dec 15 21:13:32 GMT 2023
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EPA CompTox
DTXSID00863076
Created by admin on Fri Dec 15 21:13:32 GMT 2023 , Edited by admin on Fri Dec 15 21:13:32 GMT 2023
PRIMARY
ECHA (EC/EINECS)
221-123-8
Created by admin on Fri Dec 15 21:13:32 GMT 2023 , Edited by admin on Fri Dec 15 21:13:32 GMT 2023
PRIMARY
CAS
3008-50-2
Created by admin on Fri Dec 15 21:13:32 GMT 2023 , Edited by admin on Fri Dec 15 21:13:32 GMT 2023
PRIMARY
PUBCHEM
76366
Created by admin on Fri Dec 15 21:13:32 GMT 2023 , Edited by admin on Fri Dec 15 21:13:32 GMT 2023
PRIMARY