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Details

Stereochemistry ACHIRAL
Molecular Formula C22H17N2O5S.Na
Molecular Weight 444.436
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Acid Blue 47

SMILES

[Na+].CC1=CC=C(NC2=CC(C)=C(N)C3=C2C(=O)C4=CC=CC=C4C3=O)C(=C1)S([O-])(=O)=O

InChI

InChIKey=BADRBIXUSUCBEG-UHFFFAOYSA-M
InChI=1S/C22H18N2O5S.Na/c1-11-7-8-15(17(9-11)30(27,28)29)24-16-10-12(2)20(23)19-18(16)21(25)13-5-3-4-6-14(13)22(19)26;/h3-10,24H,23H2,1-2H3,(H,27,28,29);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C22H17N2O5S
Molecular Weight 421.446
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
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 12:01:01 GMT 2023
Edited
by admin
on Sat Dec 16 12:01:01 GMT 2023
Record UNII
W8RGM644MX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Acid Blue 47
Common Name English
C.I. 62085
Common Name English
CI 62085
Common Name English
C.I. Acid Blue 47
Common Name English
Benzenesulfonic acid, 2-[(4-amino-9,10-dihydro-3-methyl-9,10-dioxo-1-anthracenyl)amino]-5-methyl-, monosodium salt
Common Name English
Benzenesulfonic acid, 2-[(4-amino-9,10-dihydro-3-methyl-9,10-dioxo-1-anthracenyl)amino]-5-methyl-, sodium salt
Common Name English
Solway Blue RN
Common Name English
Benzenesulfonic acid, 2-[(4-amino-9,10-dihydro-3-methyl-9,10-dioxo-1-anthracenyl)amino]-5-methyl-, sodium salt (1:1)
Systematic Name English
Code System Code Type Description
CAS
4403-89-8
Created by admin on Sat Dec 16 12:01:01 GMT 2023 , Edited by admin on Sat Dec 16 12:01:01 GMT 2023
PRIMARY
FDA UNII
W8RGM644MX
Created by admin on Sat Dec 16 12:01:01 GMT 2023 , Edited by admin on Sat Dec 16 12:01:01 GMT 2023
PRIMARY
PUBCHEM
23678882
Created by admin on Sat Dec 16 12:01:01 GMT 2023 , Edited by admin on Sat Dec 16 12:01:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID5063443
Created by admin on Sat Dec 16 12:01:01 GMT 2023 , Edited by admin on Sat Dec 16 12:01:01 GMT 2023
PRIMARY
ECHA (EC/EINECS)
224-545-0
Created by admin on Sat Dec 16 12:01:01 GMT 2023 , Edited by admin on Sat Dec 16 12:01:01 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE