Sodium 4-ethoxybutane-1-sulfonate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H13O4S.Na
Molecular Weight	204.22
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Sodium 4-ethoxybutane-1-sulfonate

Structure Search

SMILES

[Na+].CCOCCCCS([O-])(=O)=O

InChI

InChIKey=ZWSMHXRHZKIZIF-UHFFFAOYSA-M

InChI=1S/C6H14O4S.Na/c1-2-10-5-3-4-6-11(7,8)9;/h2-6H2,1H3,(H,7,8,9);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count

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

Molecular Formula	C6H13O4S
Molecular Weight	181.23
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 `Tue Apr 01 19:58:45 GMT 2025` Edited by `admin` on `Tue Apr 01 19:58:45 GMT 2025`
Record UNII	LXK87FG8WG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-2741

Preferred Name

English

Sodium 4-ethoxybutane-1-sulfonate

Systematic Name

English

1-Butanesulfonic acid, 4-ethoxy-, sodium salt (1:1)

Systematic Name

English

1-Butanesulfonic acid, 4-ethoxy-, sodium salt

Systematic Name

English

Code System Code Type Description

CAS

5324-86-7

Created by admin on Tue Apr 01 19:58:45 GMT 2025 , Edited by admin on Tue Apr 01 19:58:45 GMT 2025

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NSC

2741

Created by admin on Tue Apr 01 19:58:45 GMT 2025 , Edited by admin on Tue Apr 01 19:58:45 GMT 2025

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EPA CompTox

DTXSID801349180

Created by admin on Tue Apr 01 19:58:45 GMT 2025 , Edited by admin on Tue Apr 01 19:58:45 GMT 2025

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PUBCHEM

58922096

Created by admin on Tue Apr 01 19:58:45 GMT 2025 , Edited by admin on Tue Apr 01 19:58:45 GMT 2025

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FDA UNII

LXK87FG8WG

Created by admin on Tue Apr 01 19:58:45 GMT 2025 , Edited by admin on Tue Apr 01 19:58:45 GMT 2025

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Related Record Type Details


					VQ4EC8X3M9

4-Ethoxy-1-butanesulfonic acid

PARENT -> SALT/SOLVATE

Amount: