SODIUM 5-AMINO-O-XYLENE-3-SULFONATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H10NO3S.Na
Molecular Weight	223.225
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM 5-AMINO-O-XYLENE-3-SULFONATE

Structure Search

SMILES

[Na+].CC1=C(C)C(=CC(N)=C1)S([O-])(=O)=O

InChI

InChIKey=RZPNIEXEVYHEQR-UHFFFAOYSA-M

InChI=1S/C8H11NO3S.Na/c1-5-3-7(9)4-8(6(5)2)13(10,11)12;/h3-4H,9H2,1-2H3,(H,10,11,12);/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	C8H10NO3S
Molecular Weight	200.235
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 19:05:05 GMT 2025` Edited by `admin` on `Tue Apr 01 19:05:05 GMT 2025`
Record UNII	IE9ZLG2R42
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM 5-AMINO-O-XYLENE-3-SULFONATE

Common Name

English

BENZENESULFONIC ACID, 5-AMINO-2,3-DIMETHYL-, MONOSODIUM SALT

Preferred Name

English

Code System Code Type Description

CAS

94159-54-3

Created by admin on Tue Apr 01 19:05:05 GMT 2025 , Edited by admin on Tue Apr 01 19:05:05 GMT 2025

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ECHA (EC/EINECS)

303-234-4

Created by admin on Tue Apr 01 19:05:05 GMT 2025 , Edited by admin on Tue Apr 01 19:05:05 GMT 2025

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EPA CompTox

DTXSID90240877

Created by admin on Tue Apr 01 19:05:05 GMT 2025 , Edited by admin on Tue Apr 01 19:05:05 GMT 2025

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FDA UNII

IE9ZLG2R42

Created by admin on Tue Apr 01 19:05:05 GMT 2025 , Edited by admin on Tue Apr 01 19:05:05 GMT 2025

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PUBCHEM

44146611

Created by admin on Tue Apr 01 19:05:05 GMT 2025 , Edited by admin on Tue Apr 01 19:05:05 GMT 2025

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