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Details

Stereochemistry MIXED
Molecular Formula C37H68O8
Molecular Weight 640.931
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pentaerythrityl Tetraethylhexanoate

SMILES

CCCCC(CC)C(=O)OCC(COC(=O)C(CC)CCCC)(COC(=O)C(CC)CCCC)COC(=O)C(CC)CCCC

InChI

InChIKey=DRRMRHKHTQRWMB-UHFFFAOYSA-N
InChI=1S/C37H68O8/c1-9-17-21-29(13-5)33(38)42-25-37(26-43-34(39)30(14-6)22-18-10-2,27-44-35(40)31(15-7)23-19-11-3)28-45-36(41)32(16-8)24-20-12-4/h29-32H,9-28H2,1-8H3

HIDE SMILES / InChI
Molecular Formula C37H68O8
Molecular Weight 640.931
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

1999
175
Substance Class Chemical
Created
by admin
on Mon Mar 31 20:05:39 GMT 2025
Edited
by admin
on Mon Mar 31 20:05:39 GMT 2025
Record UNII
XJ7052W897
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AEC PENTAERYTHRITYL TETRAETHYLHEXANOATE
Preferred Name English
Pentaerythrityl Tetraethylhexanoate
INCI  
INCI  
Official Name English
NIKKOL PENTARATE-408
Brand Name English
PENTAERYTHRITYL TETRA-(2-ETHYL HEXANOATE)
Common Name English
KAK PTO
Brand Name English
Hexanoic acid, 2-ethyl-, 1,1?-[2,2-bis[[(2-ethyl-1-oxohexyl)oxy]methyl]-1,3-propanediyl] ester
Systematic Name English
DUB PTO
Brand Name English
Trivent PE-48
Brand Name English
Hexanoic acid, 2-ethyl-, pentaerythritol tetraester
Systematic Name English
Pentaerythrityl tetraoctanoate
Systematic Name English
NS-408
Brand Name English
Pentaerythritol, tetrakis(2-ethylhexanoate)
Systematic Name English
Hexanoic acid, 2-ethyl-, neopentanetetrayl ester
Systematic Name English
HATCOL 5140
Brand Name English
Salacos 5408
Brand Name English
PENTAERYTHRITOL TETRA-2-ETHYLHEXANOATE
Common Name English
Pentaerythrityl tetraethylhexanoate, (±)-
Common Name English
Hexanoic acid, 2-ethyl-, tetraester with pentaerythritol
Common Name English
NIKKOL PENTALAN-408
Brand Name English
HEST P-4-O
Brand Name English
Code System Code Type Description
RXCUI
1426406
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
PRIMARY RxNorm
CAS
7299-99-2
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
PRIMARY
CAS
120097-45-2
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
SUPERSEDED
FDA UNII
XJ7052W897
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
PRIMARY
ECHA (EC/EINECS)
230-743-8
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
PRIMARY
PUBCHEM
110956
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
PRIMARY
CAS
1671073-03-2
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
SUPERSEDED
CAS
1402132-17-5
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
SUPERSEDED
DAILYMED
XJ7052W897
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
PRIMARY
EPA CompTox
DTXSID90864037
Created by admin on Mon Mar 31 20:05:39 GMT 2025 , Edited by admin on Mon Mar 31 20:05:39 GMT 2025
PRIMARY
NIH
NCATS
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