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Details

Stereochemistry ACHIRAL
Molecular Formula C32H18Cl2N6O12S4.4Na
Molecular Weight 969.643
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of DIRECT RED 46

SMILES

[Na+].[Na+].[Na+].[Na+].NC1=C(C=C2C=C(C=CC2=C1\N=N\C3=CC=C(C=C3Cl)C4=CC=C(\N=N\C5=C6C=CC(=CC6=CC(=C5N)S([O-])(=O)=O)S([O-])(=O)=O)C(Cl)=C4)S([O-])(=O)=O)S([O-])(=O)=O

InChI

InChIKey=CVJSWNBRXDCNDI-GPTZEZBUSA-J
InChI=1S/C32H22Cl2N6O12S4.4Na/c33-23-11-15(1-7-25(23)37-39-31-21-5-3-19(53(41,42)43)9-17(21)13-27(29(31)35)55(47,48)49)16-2-8-26(24(34)12-16)38-40-32-22-6-4-20(54(44,45)46)10-18(22)14-28(30(32)36)56(50,51)52;;;;/h1-14H,35-36H2,(H,41,42,43)(H,44,45,46)(H,47,48,49)(H,50,51,52);;;;/q;4*+1/p-4/b39-37+,40-38+;;;;

HIDE SMILES / InChI

Molecular Formula C32H18Cl2N6O12S4
Molecular Weight 877.684
Charge -4
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:27:21 GMT 2025
Edited
by admin
on Mon Mar 31 23:27:21 GMT 2025
Record UNII
KA3M8SN9GV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIRECT RED 46
Common Name English
C.I. 23050
Preferred Name English
C.I. DIRECT RED 46, TETRASODIUM SALT
Common Name English
DIRECT FAST PURPURINE 8B
Common Name English
2,7-NAPHTHALENEDISULFONIC ACID, 4,4'-((3,3'-DICHLORO(1,1'-BIPHENYL)-4,4'-DIYL)BIS(AZO))BIS(3-AMINO-, TETRASODIUM SALT
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID9036804
Created by admin on Mon Mar 31 23:27:21 GMT 2025 , Edited by admin on Mon Mar 31 23:27:21 GMT 2025
PRIMARY
FDA UNII
KA3M8SN9GV
Created by admin on Mon Mar 31 23:27:21 GMT 2025 , Edited by admin on Mon Mar 31 23:27:21 GMT 2025
PRIMARY
CAS
6548-29-4
Created by admin on Mon Mar 31 23:27:21 GMT 2025 , Edited by admin on Mon Mar 31 23:27:21 GMT 2025
PRIMARY
ECHA (EC/EINECS)
229-468-6
Created by admin on Mon Mar 31 23:27:21 GMT 2025 , Edited by admin on Mon Mar 31 23:27:21 GMT 2025
PRIMARY