BARIUM 3-((1-HYDROXY-2-NAPHTHYL)AZO)NAPHTHALENE-1,5-DISULPHONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H12N2O7S2.Ba
Molecular Weight	593.775
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of BARIUM 3-((1-HYDROXY-2-NAPHTHYL)AZO)NAPHTHALENE-1,5-DISULPHONATE

Structure Search

SMILES

[Ba++].OC1=C2C=CC=CC2=CC=C1\N=N\C3=CC4=C(C=CC=C4S([O-])(=O)=O)C(=C3)S([O-])(=O)=O

InChI

InChIKey=BFTAOJGBCXFTOW-QUABFQRHSA-L

InChI=1S/C20H14N2O7S2.Ba/c23-20-14-5-2-1-4-12(14)8-9-17(20)22-21-13-10-16-15(19(11-13)31(27,28)29)6-3-7-18(16)30(24,25)26;/h1-11,23H,(H,24,25,26)(H,27,28,29);/q;+2/p-2/b22-21+;

HIDE SMILES / InChI

Molecular Formula	Ba
Molecular Weight	137.327
Charge	2
Count

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

Molecular Formula	C20H12N2O7S2
Molecular Weight	456.448
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 19:33:22 GMT 2025` Edited by `admin` on `Tue Apr 01 19:33:22 GMT 2025`
Record UNII	611M28LYG3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BARIUM 3-((1-HYDROXY-2-NAPHTHYL)AZO)NAPHTHALENE-1,5-DISULPHONATE

Systematic Name

English

1,5-NAPHTHALENEDISULFONIC ACID, 3-((1-HYDROXY-2-NAPHTHALENYL)AZO)-, BARIUM SALT (1:1)

Preferred Name

English

Code System Code Type Description

ECHA (EC/EINECS)

268-058-1

Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025

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EPA CompTox

DTXSID9070957

Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025

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CAS

67990-36-7

Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025

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FDA UNII

611M28LYG3

Created by admin on Tue Apr 01 19:33:22 GMT 2025 , Edited by admin on Tue Apr 01 19:33:22 GMT 2025

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