ChemSpider 2D Image | (2-~2~H)-1,3-Benzoxazole | C7H4DNO

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

  • Molecular FormulaC7H4DNO
  • Average mass120.127 Da
  • Monoisotopic mass120.043388 Da
  • ChemSpider ID9962968

  • Non-standard isotope - Non-standard isotope

More details:

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

(2-2H)-1,3-Benzoxazol [German] [ACD/IUPAC Name]
(2-2H)-1,3-Benzoxazole [ACD/IUPAC Name]
(2-2H)-1,3-Benzoxazole [French] [ACD/IUPAC Name]
Benzoxazole-2-d [ACD/Index Name]
2-deuteriobenzoxazole

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

Density: 1.2±0.1 g/cm3
Boiling Point: 182.5±9.0 °C at 760 mmHg
Vapour Pressure: 1.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.2±3.0 kJ/mol
Flash Point: 65.3±14.6 °C
Index of Refraction: 1.609
Molar Refractivity: 34.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 11.34
ACD/KOC (pH 5.5): 197.97
ACD/LogD (pH 7.4): 1.69
ACD/BCF (pH 7.4): 11.34
ACD/KOC (pH 7.4): 197.98
Polar Surface Area: 26 Å2
Polarizability: 13.7±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 99.6±3.0 cm3

Click to predict properties on the Chemicalize site


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