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Details

Stereochemistry ACHIRAL
Molecular Formula C16H34O4S.C4H11NO2
Molecular Weight 427.639
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIETHANOLAMMONIUM CETYL SULFATE

SMILES

OCCNCCO.CCCCCCCCCCCCCCCCOS(O)(=O)=O

InChI

InChIKey=PJDFMXWUFDUYTG-UHFFFAOYSA-N
InChI=1S/C16H34O4S.C4H11NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-21(17,18)19;6-3-1-5-2-4-7/h2-16H2,1H3,(H,17,18,19);5-7H,1-4H2

HIDE SMILES / InChI

Molecular Formula C4H11NO2
Molecular Weight 105.1356
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C16H34O4S
Molecular Weight 322.504
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:16:12 GMT 2025
Edited
by admin
on Mon Mar 31 23:16:12 GMT 2025
Record UNII
L3T402CA2B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIETHANOLAMMONIUM CETYL SULFATE
Common Name English
DEA-CETYL SULFATE
INCI  
INCI  
Preferred Name English
DIETHANOLAMINE CETYL SULFATE
Systematic Name English
1-HEXADECANOL, HYDROGEN SULFATE, COMPD. WITH 2,2'-IMINOBIS(ETHANOL) (1:1)
Systematic Name English
1-HEXADECANOL, 1-(HYDROGEN SULFATE), COMPD. WITH 2,2'-IMINOBIS(ETHANOL) (1:1)
Systematic Name English
ETHANOL, 2,2'-IMINOBIS-, COMPD. WITH HEXADECYL HYDROGEN SULFATE (1:1)
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
257-260-5
Created by admin on Mon Mar 31 23:16:12 GMT 2025 , Edited by admin on Mon Mar 31 23:16:12 GMT 2025
PRIMARY
EPA CompTox
DTXSID20965869
Created by admin on Mon Mar 31 23:16:12 GMT 2025 , Edited by admin on Mon Mar 31 23:16:12 GMT 2025
PRIMARY
PUBCHEM
162646
Created by admin on Mon Mar 31 23:16:12 GMT 2025 , Edited by admin on Mon Mar 31 23:16:12 GMT 2025
PRIMARY
CAS
51541-51-6
Created by admin on Mon Mar 31 23:16:12 GMT 2025 , Edited by admin on Mon Mar 31 23:16:12 GMT 2025
PRIMARY
FDA UNII
L3T402CA2B
Created by admin on Mon Mar 31 23:16:12 GMT 2025 , Edited by admin on Mon Mar 31 23:16:12 GMT 2025
PRIMARY