ChemSpider 2D Image | (2-~2~H)-1,3-Oxazole | C3H2DNO

(2-2H)-1,3-Oxazole

  • Molecular FormulaC3H2DNO
  • Average mass70.068 Da
  • Monoisotopic mass70.027740 Da
  • ChemSpider ID57619713
  • Non-standard isotope - Non-standard isotope


More details:






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

(2-2H)-1,3-Oxazol [German] [ACD/IUPAC Name]
(2-2H)-1,3-Oxazole [ACD/IUPAC Name]
(2-2H)-1,3-Oxazole [French] [ACD/IUPAC Name]
Oxazole-2-d [ACD/Index Name]
2-Deuterio-1,3-oxazole
67245-00-5 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 69.5±9.0 °C at 760 mmHg
Vapour Pressure: 145.4±0.1 mmHg at 25°C
Enthalpy of Vaporization: 29.8±3.0 kJ/mol
Flash Point: 18.9±0.0 °C
Index of Refraction: 1.422
Molar Refractivity: 16.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.12
ACD/LogD (pH 5.5): 0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 31.52
ACD/LogD (pH 7.4): 0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.52
Polar Surface Area: 26 Å2
Polarizability: 6.6±0.5 10-24cm3
Surface Tension: 31.8±3.0 dyne/cm
Molar Volume: 65.5±3.0 cm3

Click to predict properties on the Chemicalize site






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