ChemSpider 2D Image | Thieno[3,2-c][1,2]oxazole-3-carbaldehyde | C6H3NO2S

Thieno[3,2-c][1,2]oxazole-3-carbaldehyde

  • Molecular FormulaC6H3NO2S
  • Average mass153.158 Da
  • Monoisotopic mass152.988449 Da
  • ChemSpider ID27017692

More details:

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

Thieno[3,2-c][1,2]oxazol-3-carbaldehyd [German] [ACD/IUPAC Name]
Thieno[3,2-c][1,2]oxazole-3-carbaldehyde [ACD/IUPAC Name]
Thiéno[3,2-c][1,2]oxazole-3-carbaldéhyde [French] [ACD/IUPAC Name]
Thieno[3,2-c]isoxazole-3-carboxaldehyde [ACD/Index Name]
339363-57-4 [RN]
MFCD18968219
thieno[3,2-c]isoxazole-3-carbaldehyde

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

Density: 1.5±0.1 g/cm3
Boiling Point: 315.0±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.6±3.0 kJ/mol
Flash Point: 144.3±22.3 °C
Index of Refraction: 1.716
Molar Refractivity: 39.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 1.44
ACD/BCF (pH 5.5): 7.37
ACD/KOC (pH 5.5): 145.39
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 7.37
ACD/KOC (pH 7.4): 145.39
Polar Surface Area: 71 Å2
Polarizability: 15.7±0.5 10-24cm3
Surface Tension: 66.4±3.0 dyne/cm
Molar Volume: 100.7±3.0 cm3

Click to predict properties on the Chemicalize site


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