DIRECT BLUE 218

Details

Stereochemistry	ACHIRAL
Molecular Formula	C32H16N6O16S4.2Cu.4Na
Molecular Weight	1087.811
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Na+].[Na+].[Na+].[Na+].[Cu++].[Cu++].NC1=CC(=CC2=C1C([O-])=C(\N=N/C3=C([O-])C=C(C=C3)C4=CC([O-])=C(C=C4)\N=N/C5=C([O-])C6=C(C=C(C=C6N)S([O-])(=O)=O)C=C5S([O-])(=O)=O)C(=C2)S([O-])(=O)=O)S([O-])(=O)=O

InChI

InChIKey=GWEZPAIPHHUMTI-QTSXORJLSA-F

InChI=1S/C32H24N6O16S4.2Cu.4Na/c33-19-11-17(55(43,44)45)5-15-9-25(57(49,50)51)29(31(41)27(15)19)37-35-21-3-1-13(7-23(21)39)14-2-4-22(24(40)8-14)36-38-30-26(58(52,53)54)10-16-6-18(56(46,47)48)12-20(34)28(16)32(30)42;;;;;;/h1-12,39-42H,33-34H2,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;;;/q;2*+2;4*+1/p-8/b37-35-,38-36-;;;;;;

HIDE SMILES / InChI

Molecular Formula	Cu
Molecular Weight	63.546
Charge	2
Count

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

Molecular Formula	C32H16N6O16S4
Molecular Weight	868.76
Charge	-8
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:52:41 GMT 2023` Edited by `admin` on `Sat Dec 16 08:52:41 GMT 2023`
Record UNII	RR3V5FL20N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIRECT BLUE 218

Common Name

English

TETRASODIUM (.MU.-((3,3'-((3,3'-DIHYDROXY(1,1'-BIPHENYL)-4,4'- DIYL)BIS(AZO))BIS(5-AMINO-4-HYDROXYNAPHTHALENE-2,7- DISULPHONATO))(8-)))DICUPRATE(4-)

Common Name

English

C.I. DIRECT BLUE 218

Common Name

English

CI 24401

Common Name

English

CUPRATE(4-), (.MU.-((3,3'-((3,3'-DIHYDROXY(1,1'-BIPHENYL)-4,4'-DIYL)BIS(AZO))BIS(5-AMINO-4-HYDROXY-2,7-NAPHTHALENEDISULFONATO))(8-)))DI-, TETRASODIUM

Systematic Name

English

DIRECT BLUE 218 [HSDB]

Common Name

English

(3,3'-((3,3'-DIHYDROXY-1,1'-BIPHENYL-4,4'- DIYL)BIS(AZO)BIS(5-AMINO-2,7-NAPHTHALENEDISULFONATO- (O4,O3)))DICOPPER, TETRASODIUM SALT

Common Name

English

2,7-NAPHTHALENEDISULFONIC ACID, 3,3'-((3,3'-DIHYDROXY(1,1'-BIPHENYL)-4,4'-DIYL)BIS(AZO))BIS(5-AMINO-4-HYDROXY-, COPPER COMPLEX

Systematic Name

English

CUPRATE(4-), (.MU.-((3,3'-((3,3'-DI(HYDROXY-.KAPPA.O)(1,1'-BIPHENYL)-4,4'-DIYL)BIS(AZO-.KAPPA.N1))BIS(5-AMINO-4-(HYDROXY-.KAPPA.O)-2,7-NAPHTHALENEDISULFONATO))(8-)))DI-, TETRASODIUM

Systematic Name

English

CUPRATE(4-), (.MU.-((3,3'-((3,3'-DI(HYDROXY-.KAPPA.O)(1,1'-BIPHENYL)-4,4'-DIYL)BIS(2,1-DIAZENEDIYL-.KAPPA.N1))BIS(5-AMINO-4-(HYDROXY-.KAPPA.O)-2,7-NAPHTHALENEDISULFONATO))(8-)))DI-, SODIUM (1:4)

Systematic Name

English

COPPER, (TETRAHYDROGEN-3,3'-((3,3'-DIHYDROXY-4,4'-BIPHENYLYLENE)BIS(AZO))BIS(5-AMINO-4-HYDROXY-2,7-NAPHTHALENEDISULFONATO)(4-))DI-, TETRASODIUM SALT

Systematic Name

English

2,7-NAPHTHALENEDISULFONIC ACID, 3,3'((3,3'-DIHYDROXY(1,1'- BIPHENYL)-4,4'-DIYL)BIS(AZO)BIS(5-AMINO-4-HYDROXY-, SODIUM SALT, COPPER COMPLEX

Systematic Name

English

CI DIRECT BLUE 218

Common Name

English

AMANIL SUPRA BLUE 9GL

Brand Name

English

CARTA BLUE VP

Brand Name

English

Code System Code Type Description

EPA CompTox

DTXSID2020187