DICAPRYLOYLETHYL HYDROXYETHYLMONIUM METHOSULFATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H46NO5.CH3O4S
Molecular Weight	527.712
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DICAPRYLOYLETHYL HYDROXYETHYLMONIUM METHOSULFATE

Structure Search

SMILES

COS([O-])(=O)=O.CCCCCCCC(=O)OCC[N+](C)(CCO)CCOC(=O)CCCCCCC

InChI

InChIKey=RNZVJRCYHQMGNH-UHFFFAOYSA-M

InChI=1S/C23H46NO5.CH4O4S/c1-4-6-8-10-12-14-22(26)28-20-17-24(3,16-19-25)18-21-29-23(27)15-13-11-9-7-5-2;1-5-6(2,3)4/h25H,4-21H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1

HIDE SMILES / InChI

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

Molecular Formula	C23H46NO5
Molecular Weight	416.615
Charge	1
Count

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

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:11:17 GMT 2025` Edited by `admin` on `Mon Mar 31 21:11:17 GMT 2025`
Record UNII	62FKR33F5O
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ETHANAMINIUM, N-(2-HYDROXYETHYL)-N-METHYL-2-((1-OXOOCTYL)OXY)-N-(2-((1-OXOOCTYL)OXY)ETHYL)-, METHYL SULFATE (1:1)

Preferred Name

English

DICAPRYLOYLETHYL HYDROXYETHYLMONIUM METHOSULFATE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID30176666

Created by admin on Mon Mar 31 21:11:17 GMT 2025 , Edited by admin on Mon Mar 31 21:11:17 GMT 2025

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PUBCHEM

71587653

Created by admin on Mon Mar 31 21:11:17 GMT 2025 , Edited by admin on Mon Mar 31 21:11:17 GMT 2025

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CAS

221315-91-9

Created by admin on Mon Mar 31 21:11:17 GMT 2025 , Edited by admin on Mon Mar 31 21:11:17 GMT 2025

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FDA UNII

62FKR33F5O

Created by admin on Mon Mar 31 21:11:17 GMT 2025 , Edited by admin on Mon Mar 31 21:11:17 GMT 2025

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