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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H16NO2
Molecular Weight 134.1967
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of Dimethyl diethanolammonium

SMILES

C[N+](C)(CCO)CCO

InChI

InChIKey=FIVJMCNNMIGYRO-UHFFFAOYSA-N
InChI=1S/C6H16NO2/c1-7(2,3-5-8)4-6-9/h8-9H,3-6H2,1-2H3/q+1

HIDE SMILES / InChI

Molecular Formula C6H16NO2
Molecular Weight 134.1967
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 10:12:33 GMT 2025
Edited
by admin
on Wed Apr 02 10:12:33 GMT 2025
Record UNII
7G4F77S53K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Hydroxy-N-(2-hydroxyethyl)-N,N-dimethylethanaminium
Preferred Name English
Dimethyl diethanolammonium
Common Name English
Ethanaminium, 2-hydroxy-N-(2-hydroxyethyl)-N,N-dimethyl-
Systematic Name English
Bis(2-hydroxyethyl)dimethylammonium
Common Name English
N,N-Dimethyldiethanolamine
Common Name English
Bis(2-hydroxyethyl)-dimethylazanium
Systematic Name English
Code System Code Type Description
PUBCHEM
162304
Created by admin on Wed Apr 02 10:12:33 GMT 2025 , Edited by admin on Wed Apr 02 10:12:33 GMT 2025
PRIMARY
CAS
44798-79-0
Created by admin on Wed Apr 02 10:12:33 GMT 2025 , Edited by admin on Wed Apr 02 10:12:33 GMT 2025
PRIMARY
FDA UNII
7G4F77S53K
Created by admin on Wed Apr 02 10:12:33 GMT 2025 , Edited by admin on Wed Apr 02 10:12:33 GMT 2025
PRIMARY
Related Record Type Details
IONIC MOIETY
SALT/SOLVATE -> PARENT