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Details

Stereochemistry RACEMIC
Molecular Formula C18H38NO3.Cl
Molecular Weight 351.952
Optical Activity ( + / - )
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LAUROYL PG-TRIMONIUM CHLORIDE

SMILES

[Cl-].CCCCCCCCCCCC(=O)OCC(O)C[N+](C)(C)C

InChI

InChIKey=OMSDHVIUTLVVOF-UHFFFAOYSA-M
InChI=1S/C18H38NO3.ClH/c1-5-6-7-8-9-10-11-12-13-14-18(21)22-16-17(20)15-19(2,3)4;/h17,20H,5-16H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C18H37NO3
Molecular Weight 315.4913
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity ( + / - )

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 Mon Mar 31 23:41:11 GMT 2025
Edited
by admin
on Mon Mar 31 23:41:11 GMT 2025
Record UNII
OFJ52PPI2R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LAUROYL PG TRIMONIUM CHLORIDE
Preferred Name English
LAUROYL PG-TRIMONIUM CHLORIDE
INCI  
INCI  
Official Name English
1-PROPANAMINIUM, 2-HYDROXY-N,N,N-TRIMETHYL-3-((1-OXODODECYL)OXY)-, CHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID501021226
Created by admin on Mon Mar 31 23:41:11 GMT 2025 , Edited by admin on Mon Mar 31 23:41:11 GMT 2025
PRIMARY
FDA UNII
OFJ52PPI2R
Created by admin on Mon Mar 31 23:41:11 GMT 2025 , Edited by admin on Mon Mar 31 23:41:11 GMT 2025
PRIMARY
PUBCHEM
14762091
Created by admin on Mon Mar 31 23:41:11 GMT 2025 , Edited by admin on Mon Mar 31 23:41:11 GMT 2025
PRIMARY
CAS
53171-04-3
Created by admin on Mon Mar 31 23:41:11 GMT 2025 , Edited by admin on Mon Mar 31 23:41:11 GMT 2025
PRIMARY