ChemSpider 2D Image | 4-Chloro-5-(methoxymethyl)-1,2-oxazole-3-carboxylic acid | C6H6ClNO4

4-Chloro-5-(methoxymethyl)-1,2-oxazole-3-carboxylic acid

  • Molecular FormulaC6H6ClNO4
  • Average mass191.569 Da
  • Monoisotopic mass190.998535 Da
  • ChemSpider ID44795745

More details:

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

3-Isoxazolecarboxylic acid, 4-chloro-5-(methoxymethyl)- [ACD/Index Name]
4-Chlor-5-(methoxymethyl)-1,2-oxazol-3-carbonsäure [German] [ACD/IUPAC Name]
4-Chloro-5-(methoxymethyl)-1,2-oxazole-3-carboxylic acid [ACD/IUPAC Name]
Acide 4-chloro-5-(méthoxyméthyl)-1,2-oxazole-3-carboxylique [French] [ACD/IUPAC Name]
1551757-06-2 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 342.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.8±3.0 kJ/mol
Flash Point: 160.6±27.9 °C
Index of Refraction: 1.528
Molar Refractivity: 39.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.10
ACD/LogD (pH 5.5): -2.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 15.8±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 129.1±3.0 cm3

Click to predict properties on the Chemicalize site


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