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Details

Stereochemistry ACHIRAL
Molecular Formula C49H102N.Cl
Molecular Weight 740.794
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRICETYLMONIUM CHLORIDE

SMILES

[Cl-].CCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC

InChI

InChIKey=FAGMGMRSURYROS-UHFFFAOYSA-M
InChI=1S/C49H102N.ClH/c1-5-8-11-14-17-20-23-26-29-32-35-38-41-44-47-50(4,48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-2)49-46-43-40-37-34-31-28-25-22-19-16-13-10-7-3;/h5-49H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

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

Molecular Formula C49H102N
Molecular Weight 705.3409
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 18:02:17 GMT 2025
Edited
by admin
on Mon Mar 31 18:02:17 GMT 2025
Record UNII
G2PM9I4UHZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ARQUAD PC 316
Preferred Name English
TRICETYLMONIUM CHLORIDE
INCI  
INCI  
Official Name English
TRICETYLMETHYL AMMONIUM CHLORIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
104201
Created by admin on Mon Mar 31 18:02:17 GMT 2025 , Edited by admin on Mon Mar 31 18:02:17 GMT 2025
PRIMARY
CAS
52467-63-7
Created by admin on Mon Mar 31 18:02:17 GMT 2025 , Edited by admin on Mon Mar 31 18:02:17 GMT 2025
PRIMARY
EPA CompTox
DTXSID7029374
Created by admin on Mon Mar 31 18:02:17 GMT 2025 , Edited by admin on Mon Mar 31 18:02:17 GMT 2025
PRIMARY
FDA UNII
G2PM9I4UHZ
Created by admin on Mon Mar 31 18:02:17 GMT 2025 , Edited by admin on Mon Mar 31 18:02:17 GMT 2025
PRIMARY