Tributylethylammonium ethyl sulphate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H32N.C2H5O4S
Molecular Weight	339.534
Optical Activity	NONE
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Tributylethylammonium ethyl sulphate

Structure Search

SMILES

CCOS([O-])(=O)=O.CCCC[N+](CC)(CCCC)CCCC

InChI

InChIKey=GELDODMEEMXBIV-UHFFFAOYSA-M

InChI=1S/C14H32N.C2H6O4S/c1-5-9-12-15(8-4,13-10-6-2)14-11-7-3;1-2-6-7(3,4)5/h5-14H2,1-4H3;2H2,1H3,(H,3,4,5)/q+1;/p-1

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	C14H32N
Molecular Weight	214.4106
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 `Tue Apr 01 17:52:57 GMT 2025` Edited by `admin` on `Tue Apr 01 17:52:57 GMT 2025`
Record UNII	3FGP2R7YCX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-Butanaminium, N,N-dibutyl-N-ethyl-, ethyl sulfate

Preferred Name

English

Tributylethylammonium ethyl sulphate

Common Name

English

1-Butanaminium, N,N-dibutyl-N-ethyl-, ethyl sulfate (1:1)

Systematic Name

English

Code System Code Type Description

PUBCHEM

106489

Created by admin on Tue Apr 01 17:52:57 GMT 2025 , Edited by admin on Tue Apr 01 17:52:57 GMT 2025

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FDA UNII

3FGP2R7YCX

Created by admin on Tue Apr 01 17:52:57 GMT 2025 , Edited by admin on Tue Apr 01 17:52:57 GMT 2025

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EPA CompTox

DTXSID5071046

Created by admin on Tue Apr 01 17:52:57 GMT 2025 , Edited by admin on Tue Apr 01 17:52:57 GMT 2025

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ECHA (EC/EINECS)

268-329-4

Created by admin on Tue Apr 01 17:52:57 GMT 2025 , Edited by admin on Tue Apr 01 17:52:57 GMT 2025

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CAS

68052-51-7

Created by admin on Tue Apr 01 17:52:57 GMT 2025 , Edited by admin on Tue Apr 01 17:52:57 GMT 2025

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Related Record Type Details


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Tributylethylammonium

PARENT -> SALT/SOLVATE

Amount: