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Details

Stereochemistry ACHIRAL
Molecular Formula C29H52O8
Molecular Weight 528.7184
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pentaerythritol tetrahexanoate

SMILES

CCCCCC(=O)OCC(COC(=O)CCCCC)(COC(=O)CCCCC)COC(=O)CCCCC

InChI

InChIKey=AOZDHFFNBZAHJF-UHFFFAOYSA-N
InChI=1S/C29H52O8/c1-5-9-13-17-25(30)34-21-29(22-35-26(31)18-14-10-6-2,23-36-27(32)19-15-11-7-3)24-37-28(33)20-16-12-8-4/h5-24H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C29H52O8
Molecular Weight 528.7184
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 Sat Dec 16 07:52:28 GMT 2023
Edited
by admin
on Sat Dec 16 07:52:28 GMT 2023
Record UNII
2RJA95Y9X4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Pentaerythritol tetrahexanoate
Systematic Name English
Pentaerythritol tetracaproate
Systematic Name English
Hexanoic acid, 1,1′-[2,2-bis[[(1-oxohexyl)oxy]methyl]-1,3-propanediyl] ester
Systematic Name English
1,1′-[2,2-Bis[[(1-oxohexyl)oxy]methyl]-1,3-propanediyl] dihexanoate
Systematic Name English
Pentaerythrityl tetracaproate
Systematic Name English
Code System Code Type Description
CAS
7445-47-8
Created by admin on Sat Dec 16 07:52:28 GMT 2023 , Edited by admin on Sat Dec 16 07:52:28 GMT 2023
PRIMARY
PUBCHEM
4652589
Created by admin on Sat Dec 16 07:52:28 GMT 2023 , Edited by admin on Sat Dec 16 07:52:28 GMT 2023
PRIMARY
FDA UNII
2RJA95Y9X4
Created by admin on Sat Dec 16 07:52:28 GMT 2023 , Edited by admin on Sat Dec 16 07:52:28 GMT 2023
PRIMARY