Benzoic acid, 2-[(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo]-, disodium salt

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H11N3O6S.2Na
Molecular Weight	431.33
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of Benzoic acid, 2-[(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo]-, disodium salt

Structure Search

SMILES

[Na+].[Na+].NC1=CC2=C(C=C1)C=C(C(\N=N\C3=CC=CC=C3C([O-])=O)=C2O)S([O-])(=O)=O

InChI

InChIKey=JAASVAXWTKMZPV-LLIZZRELSA-L

InChI=1S/C17H13N3O6S.2Na/c18-10-6-5-9-7-14(27(24,25)26)15(16(21)12(9)8-10)20-19-13-4-2-1-3-11(13)17(22)23;;/h1-8,21H,18H2,(H,22,23)(H,24,25,26);;/q;2*+1/p-2/b20-19+;;

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	C17H11N3O6S
Molecular Weight	385.351
Charge	-2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:52:55 GMT 2025` Edited by `admin` on `Tue Apr 01 18:52:55 GMT 2025`
Record UNII	QLN3LZ34KC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Benzoic acid, 2-[(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)azo]-, disodium salt

Systematic Name

English

Benzoic acid, 2-[2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-, sodium salt (1:2)

Preferred Name

English

Code System Code Type Description

CAS

66214-42-4

Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025

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ECHA (EC/EINECS)

266-243-1

Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025

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EPA CompTox

DTXSID1070434

Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025

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FDA UNII

QLN3LZ34KC

Created by admin on Tue Apr 01 18:52:55 GMT 2025 , Edited by admin on Tue Apr 01 18:52:55 GMT 2025

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Benzoic acid, 2-[2-(7-amino-1-hydroxy-3-sulfo-2-naphthalenyl)diazenyl]-

PARENT -> SALT/SOLVATE

Amount: