PATENT BLUE V

CAS No.
3536-49-0
CCD No.
CCD00025167
Formula
2 C27 H31 N2 O7 S2 . Ca
MolWeight
1159.44

Basic Information

Product Name: PATENT BLUE V
CAS: 3536-49-0
English Synonyms: FOOD BLUE 5 ; FOOD BLUE 5 CALCIUM SALT ; PATENT BLUE V CALCIUM SALT ; XYLENE BLUE V ; ACID BLUE V CALCIUM SALT ; PATENT BLUE V HEMICALCIUM SALT ; M-HYDROXYTETRAETHYLDIAMINO-TRIPHENYL-CARBINOL ANHYDRIDE DISULFONIC ACID CALCIUM SALT ; ACID BLUE 3 ; BESTIPHARMA 507-714 ; ACID BLUE 3 CALCIUM SALT ; PATENT BLUE V, CA SALT ; PATENT BLUE V
MDL Number.: MFCD00038746
H bond acceptor: 9
H bond donor: 1
Smile: CCN(CC)c1ccc(cc1)C(=C2C=CC(=[N+](CC)CC)C=C2)c3cc(c(cc3S(=O)(=O)[O-])S(=O)(=O)[O-])O.CCN(CC)c1ccc(cc1)C(=C2C=CC(=[N+](CC)CC)C=C2)c3cc(c(cc3S(=O)(=O)[O-])S(=O)(=O)[O-])O.[Ca+2]
InChi: InChI=1S/2C27H32N2O7S2.Ca/c2*1-5-28(6-2)21-13-9-19(10-14-21)27(20-11-15-22(16-12-20)29(7-3)8-4)23-17-24(30)26(38(34,35)36)18-25(23)37(31,32)33;/h2*9-18H,5-8H2,1-4H3,(H2-,30,31,32,33,34,35,36);/q;;+2/p-2
InChiKey: InChIKey=RTMBGDBBDQKNNZ-UHFFFAOYSA-L

Property

Comments: ASSAY METHOD: HPLC
OTHER NOTES: LITERATURE FOR PATENT BLUE VIOLET DISCUSSES TWO DYES WHICH ARE VERY SIMILAR, COLOR INDEX NUMBERS 42045 AND 42051. STRUCTURALLY THEY DIFFER WITH REGARD TO THE SUBSTITUENTS ON ONE OF THE AROMATIC RINGS. CI 42045 IS 2,4-DISULFO-SUBSTITUTED WHILE CI 42051 IS 2,4-DISULFO-5-HYDROXY-SUBSTITUTED. THIS IS THE LATTER FORM
RTECS: KH2752000
WGK: 3
Specification: ANALYTICAL STANDARD

Safety information

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