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Details

Stereochemistry ACHIRAL
Molecular Formula 2C10H15NO.H2O4S
Molecular Weight 428.543
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-DIETHYL-M-AMINOPHENOL SULFATE

SMILES

OS(O)(=O)=O.CCN(CC)C1=CC(O)=CC=C1.CCN(CC)C2=CC(O)=CC=C2

InChI

InChIKey=UBHOMCCCACORIM-UHFFFAOYSA-N
InChI=1S/2C10H15NO.H2O4S/c2*1-3-11(4-2)9-6-5-7-10(12)8-9;1-5(2,3)4/h2*5-8,12H,3-4H2,1-2H3;(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula H2O4S
Molecular Weight 98.078
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C10H15NO
Molecular Weight 165.2322
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 21:02:35 GMT 2025
Edited
by admin
on Mon Mar 31 21:02:35 GMT 2025
Record UNII
844LWH5BJD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
RODOL DEMAPS
Preferred Name English
N,N-DIETHYL-M-AMINOPHENOL SULFATE
INCI  
INCI  
Official Name English
BIS((DIETHYLHYDROXYPHENYL)AMMONIUM) SULPHATE
Systematic Name English
3-(DIMETHYLAMINO)PHENOL SULFATE
Systematic Name English
PHENOL, 3-(DIETHYLAMINO)-, SULFATE (2:1)
Systematic Name English
PHENOL, 3-(DIETHYLAMINO)-, SULFATE (2:1) (SALT)
Common Name English
Code System Code Type Description
PUBCHEM
109926
Created by admin on Mon Mar 31 21:02:35 GMT 2025 , Edited by admin on Mon Mar 31 21:02:35 GMT 2025
PRIMARY
FDA UNII
844LWH5BJD
Created by admin on Mon Mar 31 21:02:35 GMT 2025 , Edited by admin on Mon Mar 31 21:02:35 GMT 2025
PRIMARY
ECHA (EC/EINECS)
269-478-8
Created by admin on Mon Mar 31 21:02:35 GMT 2025 , Edited by admin on Mon Mar 31 21:02:35 GMT 2025
PRIMARY
CAS
68239-84-9
Created by admin on Mon Mar 31 21:02:35 GMT 2025 , Edited by admin on Mon Mar 31 21:02:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID4071342
Created by admin on Mon Mar 31 21:02:35 GMT 2025 , Edited by admin on Mon Mar 31 21:02:35 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE