ChemSpider 2D Image | CX-5011 | C20H12N4O2

CX-5011

  • Molecular FormulaC20H12N4O2
  • Average mass340.335 Da
  • Monoisotopic mass340.096039 Da
  • ChemSpider ID23078341

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1009821-06-0 [RN]
5-((3-Ethynylphenyl)amino)pyrimido[4,5-c]quinoline-8-carboxylic acid
5-[(3-Ethinylphenyl)amino]pyrimido[4,5-c]chinolin-8-carbonsäure [German] [ACD/IUPAC Name]
5-[(3-ethynylphenyl)amino]pyrimido[4,5-c]quinoline-8-carboxylic acid [ACD/IUPAC Name]
Acide 5-[(3-éthynylphényl)amino]pyrimido[4,5-c]quinoléine-8-carboxylique [French] [ACD/IUPAC Name]
CX-5011
CX-5011 FREE ACID
[1009821-06-0] [RN]
1333382-30-1 [RN]
5-((3-Ethynylphenyl)amino)pyrimido-[4,5-c]quinoline-8-carboxylic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 570.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.0±3.0 kJ/mol
Flash Point: 298.9±30.1 °C
Index of Refraction: 1.781
Molar Refractivity: 97.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.50
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 4.08
ACD/KOC (pH 5.5): 22.85
ACD/LogD (pH 7.4): 0.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.72
Polar Surface Area: 88 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 94.7±5.0 dyne/cm
Molar Volume: 230.9±5.0 cm3

Click to predict properties on the Chemicalize site


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