U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C32H21N6O11S3.3Na
Molecular Weight 830.707
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of DIRECT BLUE 2

SMILES

[Na+].[Na+].[Na+].NC1=CC2=C(C=C1)C=C(C(\N=N\C3=CC=C(C=C3)C4=CC=C(C=C4)\N=N\C5=C(O)C6=C(C=C(C=C6N)S([O-])(=O)=O)C=C5S([O-])(=O)=O)=C2O)S([O-])(=O)=O

InChI

InChIKey=FKVXIGHJGBQFIH-BOXWNSCSSA-K
InChI=1S/C32H24N6O11S3.3Na/c33-20-6-1-18-12-26(51(44,45)46)29(31(39)24(18)14-20)37-35-21-7-2-16(3-8-21)17-4-9-22(10-5-17)36-38-30-27(52(47,48)49)13-19-11-23(50(41,42)43)15-25(34)28(19)32(30)40;;;/h1-15,39-40H,33-34H2,(H,41,42,43)(H,44,45,46)(H,47,48,49);;;/q;3*+1/p-3/b37-35+,38-36+;;;

HIDE SMILES / InChI

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

Molecular Formula C32H21N6O11S3
Molecular Weight 761.738
Charge -3
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 Fri Dec 15 17:12:44 GMT 2023
Edited
by admin
on Fri Dec 15 17:12:44 GMT 2023
Record UNII
EE5HVP9RA8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIRECT BLUE 2
Common Name English
CI DIRECT BLUE 2
Common Name English
NSC-75779
Code English
C.I. DIRECT BLUE 2, TRISODIUM SALT
Common Name English
TRISODIUM 5-AMINO-3-((4'-((7-AMINO-1-HYDROXY-3-SULPHONATO-2- NAPHTHYL)AZO)(1,1'-BIPHENYL)-4-YL)AZO)-4-HYDROXYNAPHTHALENE- 2,7-DISULPHONATE
Common Name English
2,7-NAPHTHALENEDISULFONIC ACID, 5-AMINO-3-((4'-((7-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHALENYL)AZO)(1,1'-BIPHENYL)-4-YL)AZO)-4-HYDROXY-, TRISODIUM SALT
Systematic Name English
CHROME LEATHER BLACK CR
Brand Name English
2,7-NAPHTHALENEDISULFONIC ACID, 5-AMINO-3-(2-(4'-(2-(7-AMINO-1-HYDROXY-3-SULFO-2-NAPHTHALENYL)DIAZENYL)(1,1'-BIPHENYL)-4-YL)DIAZENYL)-4-HYDROXY-, SODIUM SALT (1:3)
Systematic Name English
CI 22590
Common Name English
BENCIDAL NAVY BLUE BH
Brand Name English
C.I. DIRECT BLUE 2 [HSDB]
Common Name English
Code System Code Type Description
FDA UNII
EE5HVP9RA8
Created by admin on Fri Dec 15 17:12:44 GMT 2023 , Edited by admin on Fri Dec 15 17:12:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID6025191
Created by admin on Fri Dec 15 17:12:44 GMT 2023 , Edited by admin on Fri Dec 15 17:12:44 GMT 2023
PRIMARY
NSC
75779
Created by admin on Fri Dec 15 17:12:44 GMT 2023 , Edited by admin on Fri Dec 15 17:12:44 GMT 2023
PRIMARY
HSDB
4219
Created by admin on Fri Dec 15 17:12:44 GMT 2023 , Edited by admin on Fri Dec 15 17:12:44 GMT 2023
PRIMARY
RXCUI
2054103
Created by admin on Fri Dec 15 17:12:44 GMT 2023 , Edited by admin on Fri Dec 15 17:12:44 GMT 2023
PRIMARY
CAS
2429-73-4
Created by admin on Fri Dec 15 17:12:44 GMT 2023 , Edited by admin on Fri Dec 15 17:12:44 GMT 2023
PRIMARY
ECHA (EC/EINECS)
219-384-8
Created by admin on Fri Dec 15 17:12:44 GMT 2023 , Edited by admin on Fri Dec 15 17:12:44 GMT 2023
PRIMARY
DAILYMED
EE5HVP9RA8
Created by admin on Fri Dec 15 17:12:44 GMT 2023 , Edited by admin on Fri Dec 15 17:12:44 GMT 2023
PRIMARY