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

Details

Stereochemistry RACEMIC
Molecular Formula C22H42O4
Molecular Weight 370.5665
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUTYLENE GLYCOL 1-CAPRATE 3-CAPRYLATE

SMILES

CCCCCCCCCC(=O)OCCC(C)OC(=O)CCCCCCC

InChI

InChIKey=UAPYQYSNTVDNCI-UHFFFAOYSA-N
InChI=1S/C22H42O4/c1-4-6-8-10-11-13-14-16-21(23)25-19-18-20(3)26-22(24)17-15-12-9-7-5-2/h20H,4-19H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C22H42O4
Molecular Weight 370.5665
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 00:30:48 GMT 2023
Edited
by admin
on Sat Dec 16 00:30:48 GMT 2023
Record UNII
73KW58OP8O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUTYLENE GLYCOL 1-CAPRATE 3-CAPRYLATE
Common Name English
3-(OCTANOYLOXY)BUTYL DECANOATE
Systematic Name English
Code System Code Type Description
FDA UNII
73KW58OP8O
Created by admin on Sat Dec 16 00:30:48 GMT 2023 , Edited by admin on Sat Dec 16 00:30:48 GMT 2023
PRIMARY
DAILYMED
73KW58OP8O
Created by admin on Sat Dec 16 00:30:48 GMT 2023 , Edited by admin on Sat Dec 16 00:30:48 GMT 2023
PRIMARY
PUBCHEM
139032904
Created by admin on Sat Dec 16 00:30:48 GMT 2023 , Edited by admin on Sat Dec 16 00:30:48 GMT 2023
PRIMARY
RXCUI
1798299
Created by admin on Sat Dec 16 00:30:48 GMT 2023 , Edited by admin on Sat Dec 16 00:30:48 GMT 2023
PRIMARY