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Details

Stereochemistry MIXED
Molecular Formula C21H40O4
Molecular Weight 356.5399
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEOPENTYL GLYCOL DIETHYLHEXANOATE

SMILES

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

InChI

InChIKey=GORMSINSWZJIKL-UHFFFAOYSA-N
InChI=1S/C21H40O4/c1-7-11-13-17(9-3)19(22)24-15-21(5,6)16-25-20(23)18(10-4)14-12-8-2/h17-18H,7-16H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C21H40O4
Molecular Weight 356.5399
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:32:31 UTC 2023
Edited
by admin
on Fri Dec 15 15:32:31 UTC 2023
Record UNII
U68ZV6W62C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEOPENTYL GLYCOL DIETHYLHEXANOATE
INCI  
INCI  
Official Name English
SCHERCEMOL NGDO
Brand Name English
NEOPENTYL GLYCOL DIISOOCTANOATE
Systematic Name English
NEOPENTYLGLYCOL DI-2-ETHYLHEXANOATE
Common Name English
NEOPENTYL GLYCOL DIETHYLHEXANOATE [INCI]
Common Name English
KAK-NDO
Brand Name English
COSMOL 525
Brand Name English
NEOPENTYL GLYCOL DIOCTANOATE
Systematic Name English
HEXANOIC ACID, 2-ETHYL-, 1,1'-(2,2-DIMETHYL-1,3-PROPANEDIYL) ESTER
Common Name English
HEXANOIC ACID, 2-ETHYL-, 2,2-DIMETHYLTRIMETHYLENE ESTER
Common Name English
HEXANOIC ACID, 2-ETHYL-, 2,2-DIMETHYL-1,3-PROPANEDIYL ESTER
Common Name English
1,3-PROPANEDIOL, 2,2-DIMETHYL-, BIS(2-ETHYLHEXANOATE)
Common Name English
NEOPENTYL GLYCOL BIS(2-ETHYLHEXANOATE)
Systematic Name English
Code System Code Type Description
RXCUI
1307148
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY RxNorm
PUBCHEM
34260
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY
FDA UNII
U68ZV6W62C
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY
MESH
C097924
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY
CAS
28510-23-8
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY
SMS_ID
300000031705
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY
DAILYMED
U68ZV6W62C
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY
ECHA (EC/EINECS)
249-060-1
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY
EPA CompTox
DTXSID20865431
Created by admin on Fri Dec 15 15:32:31 UTC 2023 , Edited by admin on Fri Dec 15 15:32:31 UTC 2023
PRIMARY