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Details

Stereochemistry ACHIRAL
Molecular Formula C25H44Cl2N
Molecular Weight 429.53
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of PALMITYLDIMETHYL(3,4-DICHLOROBENZYL)AMMONIUM

SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=C(Cl)C(Cl)=C1

InChI

InChIKey=UWLMYWJXJWLKFV-UHFFFAOYSA-N
InChI=1S/C25H44Cl2N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-28(2,3)22-23-18-19-24(26)25(27)21-23/h18-19,21H,4-17,20,22H2,1-3H3/q+1

HIDE SMILES / InChI

Molecular Formula C25H44Cl2N
Molecular Weight 429.53
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 11:26:09 GMT 2025
Edited
by admin
on Wed Apr 02 11:26:09 GMT 2025
Record UNII
8G8A7G978H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PALMITYLDIMETHYL(3,4-DICHLOROBENZYL)AMMONIUM
Systematic Name English
BENZENEMETHANAMINIUM, 3,4-DICHLORO-N-HEXADECYL-N,N-DIMETHYL-
Preferred Name English
CETYL(3,4-DICHLOROBENZYL)DIMETHYLAMMONIUM
Systematic Name English
PALMITYLDIMETHYL(3,4-DICHLOROBENZYL)AMMONIUM ION
Systematic Name English
Code System Code Type Description
CAS
58390-80-0
Created by admin on Wed Apr 02 11:26:09 GMT 2025 , Edited by admin on Wed Apr 02 11:26:09 GMT 2025
PRIMARY
FDA UNII
8G8A7G978H
Created by admin on Wed Apr 02 11:26:09 GMT 2025 , Edited by admin on Wed Apr 02 11:26:09 GMT 2025
PRIMARY
PUBCHEM
90678942
Created by admin on Wed Apr 02 11:26:09 GMT 2025 , Edited by admin on Wed Apr 02 11:26:09 GMT 2025
PRIMARY
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