SODIUM DIETHYLBENZENESULFONATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H13O3S.Na
Molecular Weight	236.263
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM DIETHYLBENZENESULFONATE

Structure Search

SMILES

[Na+].CCC1=C(CC)C(=CC=C1)S([O-])(=O)=O

InChI

InChIKey=SKJRBEMRFHEXMA-UHFFFAOYSA-M

InChI=1S/C10H14O3S.Na/c1-3-8-6-5-7-10(9(8)4-2)14(11,12)13;/h5-7H,3-4H2,1-2H3,(H,11,12,13);/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	C10H13O3S
Molecular Weight	213.273
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 19:16:32 GMT 2025` Edited by `admin` on `Tue Apr 01 19:16:32 GMT 2025`
Record UNII	E7C5N4LDF6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM DIETHYLBENZENESULFONATE

Systematic Name

English

NSC-233932

Preferred Name

English

Benzenesulfonic acid, 2,3-diethyl-, sodium salt (1:1)

Systematic Name

English

NSC-5793

Code

English

Code System Code Type Description

FDA UNII

E7C5N4LDF6

Created by admin on Tue Apr 01 19:16:32 GMT 2025 , Edited by admin on Tue Apr 01 19:16:32 GMT 2025

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CAS

43145-62-6

Created by admin on Tue Apr 01 19:16:32 GMT 2025 , Edited by admin on Tue Apr 01 19:16:32 GMT 2025

NON-SPECIFIC SUBSTITUTION

CAS

1135306-73-8

Created by admin on Tue Apr 01 19:16:32 GMT 2025 , Edited by admin on Tue Apr 01 19:16:32 GMT 2025

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ECHA (EC/EINECS)

256-116-9

Created by admin on Tue Apr 01 19:16:32 GMT 2025 , Edited by admin on Tue Apr 01 19:16:32 GMT 2025

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NSC

233932

Created by admin on Tue Apr 01 19:16:32 GMT 2025 , Edited by admin on Tue Apr 01 19:16:32 GMT 2025

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NSC

5793

Created by admin on Tue Apr 01 19:16:32 GMT 2025 , Edited by admin on Tue Apr 01 19:16:32 GMT 2025

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EPA CompTox

DTXSID80195721

Created by admin on Tue Apr 01 19:16:32 GMT 2025 , Edited by admin on Tue Apr 01 19:16:32 GMT 2025

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PUBCHEM

23684581

Created by admin on Tue Apr 01 19:16:32 GMT 2025 , Edited by admin on Tue Apr 01 19:16:32 GMT 2025

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