U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C23H44O4
Molecular Weight 384.5931
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEOPENTYL GLYCOL CAPRYLATE/CAPRATE

SMILES

CCCCCCCCCC(=O)OCC(C)(C)COC(=O)CCCCCCC

InChI

InChIKey=WQCCBVAECCKLRI-UHFFFAOYSA-N
InChI=1S/C23H44O4/c1-5-7-9-11-12-14-16-18-22(25)27-20-23(3,4)19-26-21(24)17-15-13-10-8-6-2/h5-20H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C23H44O4
Molecular Weight 384.5931
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 01:36:41 GMT 2023
Edited
by admin
on Sat Dec 16 01:36:41 GMT 2023
Record UNII
CI933M177A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEOPENTYL GLYCOL CAPRYLATE/CAPRATE
Common Name English
NEOPENTYL GLYCOL MONOCAPRYLATE/MONOCAPRATE
Common Name English
(2,2-DIMETHYL-3-OCTANOYLOXY-PROPYL) DECANOATE
Systematic Name English
Code System Code Type Description
RXCUI
1307101
Created by admin on Sat Dec 16 01:36:41 GMT 2023 , Edited by admin on Sat Dec 16 01:36:41 GMT 2023
PRIMARY
PUBCHEM
22565008
Created by admin on Sat Dec 16 01:36:41 GMT 2023 , Edited by admin on Sat Dec 16 01:36:41 GMT 2023
PRIMARY
FDA UNII
CI933M177A
Created by admin on Sat Dec 16 01:36:41 GMT 2023 , Edited by admin on Sat Dec 16 01:36:41 GMT 2023
PRIMARY