ChemSpider 2D Image | Methyl 4-chloro-5-methoxy-1,2-oxazole-3-carboxylate | C6H6ClNO4

Methyl 4-chloro-5-methoxy-1,2-oxazole-3-carboxylate

  • Molecular FormulaC6H6ClNO4
  • Average mass191.569 Da
  • Monoisotopic mass190.998535 Da
  • ChemSpider ID45604627

More details:

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

3-Isoxazolecarboxylic acid, 4-chloro-5-methoxy-, methyl ester [ACD/Index Name]
4-Chloro-5-méthoxy-1,2-oxazole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4-chloro-5-methoxy-1,2-oxazole-3-carboxylate [ACD/IUPAC Name]
Methyl-4-chlor-5-methoxy-1,2-oxazol-3-carboxylat [German] [ACD/IUPAC Name]
1782273-11-3 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 295.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.5±3.0 kJ/mol
Flash Point: 132.3±25.9 °C
Index of Refraction: 1.486
Molar Refractivity: 40.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.48
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 3.17
ACD/KOC (pH 5.5): 79.58
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 3.17
ACD/KOC (pH 7.4): 79.58
Polar Surface Area: 62 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 139.3±3.0 cm3

Click to predict properties on the Chemicalize site


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