ChemSpider 2D Image | 7-Chloro-4H-indeno[2,1-d][1,2]oxazole-3-carboxylic acid | C11H6ClNO3

7-Chloro-4H-indeno[2,1-d][1,2]oxazole-3-carboxylic acid

  • Molecular FormulaC11H6ClNO3
  • Average mass235.623 Da
  • Monoisotopic mass235.003616 Da
  • ChemSpider ID60771698

More details:

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

4H-Indeno[2,1-d]isoxazole-3-carboxylic acid, 7-chloro- [ACD/Index Name]
7-Chlor-4H-indeno[2,1-d][1,2]oxazol-3-carbonsäure [German] [ACD/IUPAC Name]
7-Chloro-4H-indeno[2,1-d][1,2]oxazole-3-carboxylic acid [ACD/IUPAC Name]
Acide 7-chloro-4H-indéno[2,1-d][1,2]oxazole-3-carboxylique [French] [ACD/IUPAC Name]
1245153-81-4 [RN]
MFCD17195669

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

Density: 1.6±0.1 g/cm3
Boiling Point: 472.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.4±3.0 kJ/mol
Flash Point: 239.3±28.7 °C
Index of Refraction: 1.676
Molar Refractivity: 56.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 0.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.89
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 71.6±3.0 dyne/cm
Molar Volume: 148.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement