HEXADECYLOCTADECYLDIMETHYLAMMONIUM ACETATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C36H76N.C2H3O2
Molecular Weight	582.0394
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of HEXADECYLOCTADECYLDIMETHYLAMMONIUM ACETATE

Structure Search

SMILES

CC([O-])=O.CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCCCCCC

InChI

InChIKey=ZQTWKPIUNALOIU-UHFFFAOYSA-M

InChI=1S/C36H76N.C2H4O2/c1-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-37(3,4)35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-2;1-2(3)4/h5-36H2,1-4H3;1H3,(H,3,4)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C2H3O2
Molecular Weight	59.044
Charge	-1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C36H76N
Molecular Weight	522.9953
Charge	1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Lab disinfectant harms mouse fertility. Patricia Hunt interviewed by Brendan Maher.	2008-06-19	18563110
The effect of a quaternary ammonium biocide on the performance and characteristics of laboratory-scale rotating biological contactors.	2002	12452962

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:18:23 GMT 2025` Edited by `admin` on `Mon Mar 31 23:18:23 GMT 2025`
Record UNII	A566L3SA0H
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

HEXADECYLOCTADECYLDIMETHYLAMMONIUM ACETATE

Systematic Name

English

CETYL STEARYL DIMETHYL AMMONIUM ACETATE

Preferred Name

English

Code System Code Type Description

PUBCHEM

119025814

Created by admin on Mon Mar 31 23:18:23 GMT 2025 , Edited by admin on Mon Mar 31 23:18:23 GMT 2025

PRIMARY

FDA UNII

A566L3SA0H

Created by admin on Mon Mar 31 23:18:23 GMT 2025 , Edited by admin on Mon Mar 31 23:18:23 GMT 2025

PRIMARY