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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H15O3.Na
Molecular Weight 182.1927
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 2-(Hexyloxy)acetate

SMILES

[Na+].CCCCCCOCC([O-])=O

InChI

InChIKey=NXGTZNGDNOLYMZ-UHFFFAOYSA-M
InChI=1S/C8H16O3.Na/c1-2-3-4-5-6-11-7-8(9)10;/h2-7H2,1H3,(H,9,10);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Sodium 2-(Hexyloxy)acetate
Common Name English
Acetic acid, (hexyloxy)-, sodium salt
Preferred Name English
Acetic acid, 2-(hexyloxy)-, sodium salt (1:1)
Common Name English
Code System Code Type Description
PUBCHEM
101981521
Created by admin on Wed Apr 02 15:16:40 GMT 2025 , Edited by admin on Wed Apr 02 15:16:40 GMT 2025
PRIMARY
FDA UNII
HE4M974TEC
Created by admin on Wed Apr 02 15:16:40 GMT 2025 , Edited by admin on Wed Apr 02 15:16:40 GMT 2025
PRIMARY
CAS
72170-34-4
Created by admin on Wed Apr 02 15:16:40 GMT 2025 , Edited by admin on Wed Apr 02 15:16:40 GMT 2025
PRIMARY
PARENT (SALT/SOLVATE)
Structure of 2-(Hexyloxy)acetic acid
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966