PALMITOYL ETHYLTRIMONIUM METHOSULFATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H44NO2.CH3O4S
Molecular Weight	453.677
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PALMITOYL ETHYLTRIMONIUM METHOSULFATE

Structure Search

SMILES

COS([O-])(=O)=O.CCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)C

InChI

InChIKey=IASKQIFZUDEQJJ-UHFFFAOYSA-M

InChI=1S/C21H44NO2.CH4O4S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(23)24-20-19-22(2,3)4;1-5-6(2,3)4/h5-20H2,1-4H3;1H3,(H,2,3,4)/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula	C21H44NO2
Molecular Weight	342.5796
Charge	1
Count

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

Molecular Formula	CH3O4S
Molecular Weight	111.097
Charge	-1
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 `Sat Dec 16 01:52:53 GMT 2023` Edited by `admin` on `Sat Dec 16 01:52:53 GMT 2023`
Record UNII	X6LO77A67D
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PALMITOYL ETHYLTRIMONIUM METHOSULFATE

Official Name

English

ETHANAMINIUM, N,N,N-TRIMETHYL-2-((1-OXOHEXADECYL)OXY)-, METHYL SULFATE

Common Name

English

SURFACTIVE V 16

Brand Name

English

PALMITOYL ETHYLTRIMONIUM METHOSULFATE [INCI]

Common Name

English

ETHANAMINIUM, N,N,N-TRIMETHYL-2-((1-OXOHEXADECYL)OXY)-, METHYL SULFATE (1:1)

Common Name

English

Code System Code Type Description

CAS

116246-03-8

Created by admin on Sat Dec 16 01:52:53 GMT 2023 , Edited by admin on Sat Dec 16 01:52:53 GMT 2023

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PUBCHEM

11270956

Created by admin on Sat Dec 16 01:52:53 GMT 2023 , Edited by admin on Sat Dec 16 01:52:53 GMT 2023

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FDA UNII

X6LO77A67D

Created by admin on Sat Dec 16 01:52:53 GMT 2023 , Edited by admin on Sat Dec 16 01:52:53 GMT 2023

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EPA CompTox

DTXSID00151324

Created by admin on Sat Dec 16 01:52:53 GMT 2023 , Edited by admin on Sat Dec 16 01:52:53 GMT 2023

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METHYL SULFATE

PARENT -> SALT/SOLVATE