ChemSpider 2D Image | 3-[(4-Methylphenyl)amino]-1-oxo-1H-indene-2-carboxylic acid | C17H13NO3

3-[(4-Methylphenyl)amino]-1-oxo-1H-indene-2-carboxylic acid

  • Molecular FormulaC17H13NO3
  • Average mass279.290 Da
  • Monoisotopic mass279.089539 Da
  • ChemSpider ID30658785

More details:

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

1H-Indene-2-carboxylic acid, 3-[(4-methylphenyl)amino]-1-oxo- [ACD/Index Name]
3-[(4-Methylphenyl)amino]-1-oxo-1H-inden-2-carbonsäure [German] [ACD/IUPAC Name]
3-[(4-Methylphenyl)amino]-1-oxo-1H-indene-2-carboxylic acid [ACD/IUPAC Name]
Acide 3-[(4-méthylphényl)amino]-1-oxo-1H-indène-2-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 452.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 227.4±28.7 °C
Index of Refraction: 1.722
Molar Refractivity: 78.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.81
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 74.2±3.0 dyne/cm
Molar Volume: 197.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement