BEHENAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C29H61N2O.C2H5O4S
Molecular Weight	578.931
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of BEHENAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE

Structure Search

SMILES

CCOS([O-])(=O)=O.CCCCCCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC

InChI

InChIKey=TWZQMJMHQQZDPA-UHFFFAOYSA-N

InChI=1S/C29H60N2O.C2H6O4S/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-29(32)30-27-25-28-31(3,4)6-2;1-2-6-7(3,4)5/h5-28H2,1-4H3;2H2,1H3,(H,3,4,5)

HIDE SMILES / InChI

Molecular Formula	C2H5O4S
Molecular Weight	125.124
Charge	-1
Count

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

Molecular Formula	C29H61N2O
Molecular Weight	453.8074
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 `Wed Apr 02 18:02:16 GMT 2025` Edited by `admin` on `Wed Apr 02 18:02:16 GMT 2025`
Record UNII	75GI9VN0RS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CORUM 5122

Preferred Name

English

BEHENAMIDOPROPYL ETHYLDIMONIUM ETHOSULFATE

Official Name

English

1-PROPANAMINIUM, N-ETHYL-N,N-DIMETHYL-3-((1-OXODOCOSYL)AMINO)-, ETHYL SULFATE (1:1)

Common Name

English

MACKERNIUM BAPDES

Brand Name

English

1-PROPANAMINIUM, N-ETHYL-N,N-DIMETHYL-3-((1-OXODOCOSYL)AMINO)-, ETHYL SULFATE

Common Name

English

ETHYLDIMETHYLAMINOPROPYL BEHENAMIDE ETHOSULFATE

Common Name

English

SCHERCOQUAT BAS

Common Name

English

SULFURIC ACID, MONOETHYL ESTER, ION(1-), N-ETHYL-N,N-DIMETHYL-3-((1-OXODOCOSYL)AMINO)-1-PROPANAMINIUM

Common Name

English

Code System Code Type Description

FDA UNII

75GI9VN0RS

Created by admin on Wed Apr 02 18:02:16 GMT 2025 , Edited by admin on Wed Apr 02 18:02:16 GMT 2025

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EPA CompTox

DTXSID1071749

Created by admin on Wed Apr 02 18:02:16 GMT 2025 , Edited by admin on Wed Apr 02 18:02:16 GMT 2025

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CAS

68797-65-9

Created by admin on Wed Apr 02 18:02:16 GMT 2025 , Edited by admin on Wed Apr 02 18:02:16 GMT 2025

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PUBCHEM

111606

Created by admin on Wed Apr 02 18:02:16 GMT 2025 , Edited by admin on Wed Apr 02 18:02:16 GMT 2025

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ETHYL SULFATE

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