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Pigment Red 12

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  • Name Pigment Red 12
  • EINECS229-102-5
  • CAS No. 6410-32-8
  • Density1.32g/cm3
  • PSA119.87000
  • LogP7.33430
  • Solubility4.6μg/L at 23℃
  • Melting PointN/A
  • FormulaC25H20N4O4
  • Boiling Point632.7 °C at 760 mmHg
  • Molecular Weight440.45
  • Flash Point336.5 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesR36/37/38
  • Molecular Structure
    Molecular Structure of 6410-32-8 (Pigment Red 12)
  • Hazard SymbolsN/A
  • SynonymsN/A

Pigment Red 12 Specification

The Pigment Red 12 with the cas number 6410-32-8 is also called Confast Bordeaux2R. The systematic name is 3-hydroxy-4-(2-methyl-4-nitro-phenyl)azo-N-(o-tolyl)naphthalene-2-carboxamide. Its EINECS registry number is 229-102-5. The molecular formula of this chemical is C25H20N4O4. Its product category is Organics.

The properties of the chemical are: (1)ACD/LogP: 7.39; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.39; (4)ACD/LogD (pH 7.4): 7.39  ; (5)#H bond acceptors: 8; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 6; (8)Polar Surface Area: 119.87 Å2; (9)Index of Refraction: 1.665; (10)Molar Refractivity: 123.72 cm3; (11)Molar Volume: 332.9 cm3; (12)Polarizability: 49.04×10-24cm3; (13)Surface Tension: 53.7 dyne/cm; (14)Enthalpy of Vaporization: 96.96 kJ/mol; (15)Vapour Pressure: 1.33×10-16 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc4ccccc4NC(=O)c3cc1ccccc1c(N=Nc2ccc(cc2C)[N+]([O-])=O)c3O
(2)InChI: InChI=1/C25H20N4O4/c1-15-7-3-6-10-21(15)26-25(31)20-14-17-8-4-5-9-19(17)23(24(20)30)28-27-22-12-11-18(29(32)33)13-16(22)2/h3-14,30H,1-2H3,(H,26,31)
(3)InChIKey: KDLDNQQRGJAGIS-UHFFFAOYAR

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