Procion Blue HB

Molecular Formula: C29H20ClN7O11S3


InChI: InChI=1/C29H20ClN7O11S3/c30-27-35-28(33-13-4-3-5-15(10-13)49(40,41)42)37-29(36-27)34-18-9-8-14(11-20(18)50(43,44)45)32-19-12-21(51(46,47)48)24(31)23-22(19)25(38)16-6-1-2-7-17(16)26(23)39/h1-12,32H,31H2,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,33,34,35,36,37)/f/h33-34,40,43,46H

InChIKey: InChIKey=JQYMGXZJTCOARG-KIAKJPGBCE
SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=C(C=C4)NC5=NC(=NC(=N5)NC6=CC(=CC=C6)S(=O)(=O)O)Cl)S(=O)(=O)O)S(=O)(=O)O)N

Names:
    Cibacronblau F3G-A
    Cibacron Blue F 3GA
    Cibacron Blue 3G
    C.I. Reactive Blue 2
    C.I. 61211
    EINECS 235-465-0
    NSC 328383
    Procion Blue HB
    1-Amino-4-((4-((4-chloro-6-((3(or4)-sulphophenyl)amino)-1,3,5-triazin-2-yl)amino)-3-sulphophenyl)amino)-9,10-dihydro-9,10-dioxoanthracene-2-sulphonic acid
    1-amino-4-[[4-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-3-sulfo-phenyl]amino]-9,10-dioxo-anthracene-2-sulfonic acid
    12236-82-7

Registries:
    PubChem CID 656725
    PubChem ID 214456