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Details

Stereochemistry RACEMIC
Molecular Formula C22H44O3
Molecular Weight 356.583
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

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

SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(C)CCO

InChI

InChIKey=NTGPOQUYQAPDHT-UHFFFAOYSA-N
InChI=1S/C22H44O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(24)25-21(2)19-20-23/h21,23H,3-20H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C22H44O3
Molecular Weight 356.583
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 Mon Mar 31 23:23:51 GMT 2025
Edited
by admin
on Mon Mar 31 23:23:51 GMT 2025
Record UNII
4OHV550ZJW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BUTANEDIOL, 3-STEARATE
Preferred Name English
1,3-BUTYLENE GLYCOL 3-STEARATE
Common Name English
OCTADECANOIC ACID, 3-HYDROXY-1-METHYLPROPYL ESTER
Systematic Name English
1,3-BUTYLENE GLYCOL, 3-STEARATE
Common Name English
Code System Code Type Description
CAS
89457-57-8
Created by admin on Mon Mar 31 23:23:51 GMT 2025 , Edited by admin on Mon Mar 31 23:23:51 GMT 2025
PRIMARY
EPA CompTox
DTXSID70753915
Created by admin on Mon Mar 31 23:23:51 GMT 2025 , Edited by admin on Mon Mar 31 23:23:51 GMT 2025
PRIMARY
PUBCHEM
71324433
Created by admin on Mon Mar 31 23:23:51 GMT 2025 , Edited by admin on Mon Mar 31 23:23:51 GMT 2025
PRIMARY
FDA UNII
4OHV550ZJW
Created by admin on Mon Mar 31 23:23:51 GMT 2025 , Edited by admin on Mon Mar 31 23:23:51 GMT 2025
PRIMARY