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Details

Stereochemistry RACEMIC
Molecular Formula C22H42O3
Molecular Weight 354.5671
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BUTYLENE GLYCOL 1-OLEATE

SMILES

CCCCCCCC\C=C/CCCCCCCC(=O)OCCC(C)O

InChI

InChIKey=GXHLVVIUMAPGLH-KHPPLWFESA-N
InChI=1S/C22H42O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24)25-20-19-21(2)23/h10-11,21,23H,3-9,12-20H2,1-2H3/b11-10-

HIDE SMILES / InChI

Molecular Formula C22H42O3
Molecular Weight 354.5671
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:39:07 GMT 2025
Edited
by admin
on Mon Mar 31 23:39:07 GMT 2025
Record UNII
XN235374W4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BUTYLENE GLYCOL, 1-OLEATE
Preferred Name English
1,3-BUTYLENE GLYCOL 1-OLEATE
Common Name English
9-OCTADECENOIC ACID (9Z)-, 3-HYDROXYBUTYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
XN235374W4
Created by admin on Mon Mar 31 23:39:07 GMT 2025 , Edited by admin on Mon Mar 31 23:39:07 GMT 2025
PRIMARY
PUBCHEM
13922569
Created by admin on Mon Mar 31 23:39:07 GMT 2025 , Edited by admin on Mon Mar 31 23:39:07 GMT 2025
PRIMARY
CAS
107394-21-8
Created by admin on Mon Mar 31 23:39:07 GMT 2025 , Edited by admin on Mon Mar 31 23:39:07 GMT 2025
PRIMARY