Disodium 4,4?-[(4,6-diamino-1,3-phenylene)bis(azo)]bisbenzenesulfonate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H14N6O6S2.2Na
Molecular Weight	520.45
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of Disodium 4,4?-[(4,6-diamino-1,3-phenylene)bis(azo)]bisbenzenesulfonate

Structure Search

SMILES

[Na+].[Na+].NC1=CC(N)=C(C=C1\N=N\C2=CC=C(C=C2)S([O-])(=O)=O)\N=N\C3=CC=C(C=C3)S([O-])(=O)=O

InChI

InChIKey=DMWRQJGVKMKHJS-BAXPPBTCSA-L

InChI=1S/C18H16N6O6S2.2Na/c19-15-9-16(20)18(24-22-12-3-7-14(8-4-12)32(28,29)30)10-17(15)23-21-11-1-5-13(6-2-11)31(25,26)27;;/h1-10H,19-20H2,(H,25,26,27)(H,28,29,30);;/q;2*+1/p-2/b23-21+,24-22+;;

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	C18H14N6O6S2
Molecular Weight	474.47
Charge	-2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	2
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:49:55 GMT 2025` Edited by `admin` on `Mon Mar 31 21:49:55 GMT 2025`
Record UNII	UUJ85W3VQ4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Disodium 4,4?-[(4,6-diamino-1,3-phenylene)bis(azo)]bisbenzenesulfonate

Systematic Name

English

J286.881D

Preferred Name

English

Benzenesulfonic acid, 4,4?-[(4,6-diamino-m-phenylene)bis(azo)]di-, disodium salt

Systematic Name

English

Benzenesulfonic acid, 4,4?-[(4,6-diamino-1,3-phenylene)bis(azo)]bis-, disodium salt

Systematic Name

English

Code System Code Type Description

CAS

94022-42-1