ChemSpider 2D Image | 2-Acetyl-2-chloro-4-oxo-3-azetidinecarboxylic acid | C6H6ClNO4

2-Acetyl-2-chloro-4-oxo-3-azetidinecarboxylic acid

  • Molecular FormulaC6H6ClNO4
  • Average mass191.569 Da
  • Monoisotopic mass190.998535 Da
  • ChemSpider ID28700760

More details:

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

2-Acetyl-2-chlor-4-oxo-3-azetidincarbonsäure [German] [ACD/IUPAC Name]
2-Acetyl-2-chloro-4-oxo-3-azetidinecarboxylic acid [ACD/IUPAC Name]
3-Azetidinecarboxylic acid, 2-acetyl-2-chloro-4-oxo- [ACD/Index Name]
Acide 2-acétyl-2-chloro-4-oxo-3-azétidinecarboxylique [French] [ACD/IUPAC Name]
2-Acetyl-2-chloro-4-oxoazetidine-3-carboxylic acid
89403-83-8 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 481.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 81.7±6.0 kJ/mol
Flash Point: 244.7±28.7 °C
Index of Refraction: 1.555
Molar Refractivity: 38.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.60
ACD/LogD (pH 5.5): -3.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 83 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 62.9±5.0 dyne/cm
Molar Volume: 118.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement