CAS No.6486-23-3,Pigment Yellow 3 Suppliers

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Basic Information

Molecular Structure:
CAS No.:	6486-23-3
Name:	Pigment Yellow 3
Article Data:	2

Formula:	C₁₆H₁₂Cl₂N₄O₄
Molecular Weight:	395.202
Synonyms:	Acetoacetanilide,2'-chloro-2-(4-chloro-2-nitrophenylazo)- (6CI);C.I. Pigment Yellow 3 (7CI,8CI);ADC Pigment Yellow 10G;Eljon Fast Yellow 10GX;Hansa Yellow 10G;Hansa Yellow 10G Pure;Hansa Yellow 10G41;Hansa Yellow 10GT;Irgalite Yellow VG;Irgalite YellowVGX;Isol Aryl Yellow 10G;Kromon Yellow 10G Extra;LevanylYellow 10GZ;Lightfast Yellow 10G;Monolite Fast Paper Yellow 10G;Monolite Fast Yellow 10GA;Monolite Fast Yellow 10GV;Monolite Yellow 10G;OralithYellow 10G;PermansaYellow 10G;PigmentYellow 10G;Sanyo Fast Yellow 10G;Syton Fast Yellow 10G;Tertropigment Yellow 10G;Toluidine Yellow AH 177;Vulcol Yellow 10G;
EINECS:	229-355-1
Density:	1.49 g/cm³
Melting Point:	256 - 258ºC
Boiling Point:	559.1 °C at 760 mmHg
Flash Point:	291.9 °C
Appearance:	light yellow powder
Hazard Symbols:	E,C,N
Risk Codes:	R22; R35; R40; R43; R48; R50/53
PSA:	116.71000
LogP:	5.17780

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Specification

The Pigment Yellow 3, with the CAS registry number 6486-23-3, has the IUPAC name of 2-[(4-chloro-2-nitrophenyl)diazenyl]-N-(2-chlorophenyl)-3-oxobutanamide. Being a kind of light yellow powder, it could dissolve in ethanol and acetone while heated. Besides, it is usually applied in the coloration of painting, oil and other products, with the product categories including Dyes and Pigments; Organics.

The characteristics of this chemical are as below: (1)ACD/LogP: 5.35; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.02; (4)ACD/LogD (pH 7.4): 2.92; (5)ACD/BCF (pH 5.5): 320.69; (6)ACD/BCF (pH 7.4): 25.5; (7)ACD/KOC (pH 5.5): 908.15; (8)ACD/KOC (pH 7.4): 72.2; (9)#H bond acceptors: 8; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 107.92; (13)Index of Refraction: 1.65; (14)Molar Refractivity: 96.72 cm³; (15)Molar Volume: 264.8 cm³; (16)Polarizability: 38.34×10^-24 cm³; (17)Surface Tension: 57.2 dyne/cm; (18)Density: 1.49 g/cm³; (19)Flash Point: 291.9 °C; (20)Enthalpy of Vaporization: 84.14 kJ/mol; (21)Boiling Point: 559.1 °C at 760 mmHg; (22)Vapour Pressure: 1.56E-12 mmHg at 25°C; (23)Exact Mass: 394.02356; (24)MonoIsotopic Mass: 394.02356; (25)Topological Polar Surface Area: 117; (26)Heavy Atom Count: 26; (27)Complexity: 569.

Additionally, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: CC(=O)C(C(=O)NC1=CC=CC=C1Cl)N=NC2=C(C=C(C=C2)Cl)[N+](=O)[O-]
(2)InChI: InChI=1S/C16H12Cl2N4O4/c1-9(23)15(16(24)19-12-5-3-2-4-11(12)18)21-20-13-7-6-10(17)8-14(13)22(25)26/h2-8,15H,1H3,(H,19,24)
(3)InChIKey: QTSNFLIDNYOATQ-UHFFFAOYSA-N