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Solvent Blue 63

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Name

Solvent Blue 63

EINECS 229-059-2
CAS No. 6408-50-0 Density 1.312 g/cm3
PSA 58.20000 LogP 4.70170
Solubility N/A Melting Point N/A
Formula C22H18N2O2 Boiling Point 566.4 °C at 760 mmHg
Molecular Weight 342.397 Flash Point 199.1 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 6408-50-0 (Solvent Blue 63) Hazard Symbols N/A
Synonyms

Anthraquinone,1-(methylamino)-4-m-toluidino- (7CI,8CI);1-(Methylamino)-4-(3-methylanilino)anthraquinone;1-(Methylamino)-4-[(3-methylphenyl)amino]anthraquinone;C.I. 61520;C.I.Solvent Blue 63;Ceres Blue 603;Ceres Blue GN;Japan Blue 403;Kayaset Blue714;NSC 297574;Plast Blue 8540;Sico Fat Blue R 8075;Solvent Blue 63;SudanBlue GN;

Article Data 1

Solvent Blue 63 Synthetic route

128-93-8

1-bromo-4-(methylamino)-9,10-anthracenedione

108-44-1

1-amino-3-methylbenzene

6408-50-0

solvent blue 63

Conditions
ConditionsYield
With copper(II) sulfate; sodium hydroxide at 100℃; for 7h; Temperature;92%

Solvent Blue 63 Specification

The Solvent Blue 63, with the CAS registry number 6408-50-0, is also known as 1-(Methylamino)-4-[(3-methylphenyl)amino]-9,10-anthraquinone. It belongs to the product categories of Organics and Solvent Dyestuff. Its EINECS registry number is 229-059-2. This chemical's molecular formula is C22H18N2O2 and molecular weight is 342.39. What's more, its IUPAC name is 1-(Methylamino)-4-(3-methylanilino)anthracene-9,10-dione and systematic name is called 1-(Methylamino)-4-[(3-methylphenyl)amino]anthracene-9,10-dione. Solvent Blue 63 obtained from 1-Bromo-4-A aminoanthraquinone and m-Toluidine by condensation is used for all types of plastic staining. It is the red and purple dissolved in concentrated sulfuric acid, and yellow purple after dilution.

Physical properties about Solvent Blue 63 are: (1) ACD/LogP: 3.57; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 3.55; (4) ACD/LogD (pH 7.4): 3.57; (5) ACD/BCF (pH 5.5): 289.42; (6) ACD/BCF (pH 7.4): 305.29; (7) ACD/KOC (pH 5.5): 1981.04; (8) ACD/KOC (pH 7.4): 2089.65; (9) #H bond acceptors: 4; (10) #H bond donors: 2; (11) #Freely Rotating Bonds: 3; (12) Polar Surface Area: 40.62 Å2; (13) Index of Refraction: 1.715; (14) Molar Refractivity: 102.47 cm3; (15) Molar Volume: 260.8 cm3; (16) Surface Tension: 64.7 dyne/cm; (17) Density: 1.312 g/cm3; (18) Flash Point: 199.1 °C; (19) Enthalpy of Vaporization: 85.06 kJ/mol; (20) Boiling Point: 566.4 °C at 760 mmHg; (21) Vapour Pressure: 7.52E-13 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C2c1ccccc1C(=O)c3c2c(ccc3NC)Nc4cc(ccc4)C
(2) InChI: InChI=1/C22H18N2O2/c1-13-6-5-7-14(12-13)24-18-11-10-17(23-2)19-20(18)22(26)16-9-4-3-8-15(16)21(19)25/h3-12,23-24H,1-2H3
(3) InChIKey: GBAJQXFGDKEDBM-UHFFFAOYAO

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