ChemSpider 2D Image | MFCD11932907 | C16H11NO2

MFCD11932907

  • Molecular FormulaC16H11NO2
  • Average mass249.264 Da
  • Monoisotopic mass249.078979 Da
  • ChemSpider ID25465753

More details:

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

132318-11-7 [RN]
4-(2-Chinolinyl)benzoesäure [German] [ACD/IUPAC Name]
4-(2-Quinolinyl)benzoic acid [ACD/IUPAC Name]
4-(quinolin-2-yl)benzoic acid
Acide 4-(2-quinoléinyl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(2-quinolinyl)- [ACD/Index Name]
MFCD11932907
4-(QUINOLIN-2-YL)BENZOIC ACID|4-(QUINOLIN-2-YL)BENZOIC ACID

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 467.5±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 236.6±25.4 °C
Index of Refraction: 1.682
Molar Refractivity: 73.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.67
ACD/LogD (pH 5.5): 1.87
ACD/BCF (pH 5.5): 5.58
ACD/KOC (pH 5.5): 35.36
ACD/LogD (pH 7.4): 0.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.29
Polar Surface Area: 50 Å2
Polarizability: 29.2±0.5 10-24cm3
Surface Tension: 59.6±3.0 dyne/cm
Molar Volume: 194.6±3.0 cm3

Click to predict properties on the Chemicalize site


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