SODIUM 4-AMINO-5-METHOXY-O-TOLUENESULFONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H10NO4S.Na
Molecular Weight	239.224
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of SODIUM 4-AMINO-5-METHOXY-O-TOLUENESULFONATE

Structure Search

SMILES

[Na+].COC1=C(N)C=C(C)C(=C1)S([O-])(=O)=O

InChI

InChIKey=NFGPDOZQPDBBLJ-UHFFFAOYSA-M

InChI=1S/C8H11NO4S.Na/c1-5-3-6(9)7(13-2)4-8(5)14(10,11)12;/h3-4H,9H2,1-2H3,(H,10,11,12);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula	Na
Molecular Weight	22.9898
Charge	1
Count

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

Molecular Formula	C8H10NO4S
Molecular Weight	216.234
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 `Fri Dec 15 19:44:56 GMT 2023` Edited by `admin` on `Fri Dec 15 19:44:56 GMT 2023`
Record UNII	E47GLF1UEE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SODIUM 4-AMINO-5-METHOXY-O-TOLUENESULFONATE

Common Name

English

4-AMINO-5-METHOXY-2-METHYLBENZENESULFONIC ACID MONOSODIUM SALT

Common Name

English

SODIUM 4-AMINO-5-METHOXY-2-METHYLBENZENESULFONATE

Systematic Name

English

Code System Code Type Description

CAS

58936-27-9

Created by admin on Fri Dec 15 19:44:56 GMT 2023 , Edited by admin on Fri Dec 15 19:44:56 GMT 2023

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FDA UNII

E47GLF1UEE

Created by admin on Fri Dec 15 19:44:56 GMT 2023 , Edited by admin on Fri Dec 15 19:44:56 GMT 2023

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EPA CompTox

DTXSID40207677

Created by admin on Fri Dec 15 19:44:56 GMT 2023 , Edited by admin on Fri Dec 15 19:44:56 GMT 2023

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PUBCHEM

23694681

Created by admin on Fri Dec 15 19:44:56 GMT 2023 , Edited by admin on Fri Dec 15 19:44:56 GMT 2023

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Related Record Type Details


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4-AMINO-5-METHOXY-2-TOLUENESULFONIC ACID

PARENT -> SALT/SOLVATE