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Details

Stereochemistry RACEMIC
Molecular Formula C25H54NO4.Cl
Molecular Weight 468.154
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BIS-HYDROXYETHYL DIHYDROXYPROPYL STEARAMMONIUM CHLORIDE

SMILES

[Cl-].CCCCCCCCCCCCCCCCCC[N+](CCO)(CCO)CC(O)CO

InChI

InChIKey=MBIUBFJXQBUSBT-UHFFFAOYSA-M
InChI=1S/C25H54NO4.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26(19-21-27,20-22-28)23-25(30)24-29;/h25,27-30H,2-24H2,1H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C25H53NO4
Molecular Weight 431.6926
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
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 Wed Apr 02 18:40:11 GMT 2025
Edited
by admin
on Wed Apr 02 18:40:11 GMT 2025
Record UNII
32II08O72A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BISHYDROXYETHYL DIHYDROXYPROPYL STEARAMMONIUM CHLORIDE
Preferred Name English
BIS-HYDROXYETHYL DIHYDROXYPROPYL STEARAMMONIUM CHLORIDE
INCI  
INCI  
Official Name English
1-OCTADECANAMINIUM, N-(2,3-DIHYDROXYPROPYL)-N,N-BIS(2-HYDROXYETHYL)-, CHLORIDE (1:1)
Systematic Name English
MONAQUAT TG
Brand Name English
1-OCTADECANAMINIUM, N-(2,3-DIHYDROXYPROPYL)-N,N-BIS(2-HYDROXYETHYL)-, CHLORIDE
Systematic Name English
INCROQUAT TG
Brand Name English
BISHYDROXYETHYL DIHYDROXYPROPYL STEARAMMONIUM
Common Name English
JEEQUAT TG
Brand Name English
COLAQUAT HRC
Brand Name English
Code System Code Type Description
PUBCHEM
72941557
Created by admin on Wed Apr 02 18:40:11 GMT 2025 , Edited by admin on Wed Apr 02 18:40:11 GMT 2025
PRIMARY
EPA CompTox
DTXSID701021222
Created by admin on Wed Apr 02 18:40:11 GMT 2025 , Edited by admin on Wed Apr 02 18:40:11 GMT 2025
PRIMARY
DAILYMED
32II08O72A
Created by admin on Wed Apr 02 18:40:11 GMT 2025 , Edited by admin on Wed Apr 02 18:40:11 GMT 2025
PRIMARY
RXCUI
1494974
Created by admin on Wed Apr 02 18:40:11 GMT 2025 , Edited by admin on Wed Apr 02 18:40:11 GMT 2025
PRIMARY RxNorm
CAS
50744-86-0
Created by admin on Wed Apr 02 18:40:11 GMT 2025 , Edited by admin on Wed Apr 02 18:40:11 GMT 2025
PRIMARY
FDA UNII
32II08O72A
Created by admin on Wed Apr 02 18:40:11 GMT 2025 , Edited by admin on Wed Apr 02 18:40:11 GMT 2025
PRIMARY
RXCUI
1494975
Created by admin on Wed Apr 02 18:40:11 GMT 2025 , Edited by admin on Wed Apr 02 18:40:11 GMT 2025
ALTERNATIVE