ChemSpider 2D Image | 4-Isocyanato-4-(2-thienyl)tetrahydro-2H-pyran | C10H11NO2S

4-Isocyanato-4-(2-thienyl)tetrahydro-2H-pyran

  • Molecular FormulaC10H11NO2S
  • Average mass209.265 Da
  • Monoisotopic mass209.051056 Da
  • ChemSpider ID21473096

More details:

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

2H-Pyran, tetrahydro-4-isocyanato-4-(2-thienyl)- [ACD/Index Name]
4-Isocyanato-4-(2-thienyl)tetrahydro-2H-pyran [ACD/IUPAC Name]
4-Isocyanato-4-(2-thienyl)tetrahydro-2H-pyran [German] [ACD/IUPAC Name]
4-Isocyanato-4-(2-thiényl)tétrahydro-2H-pyrane [French] [ACD/IUPAC Name]
926921-63-3 [RN]
Tetrahydro-4-isocyanato-4-(2-thienyl)-2H-pyran
2-(4-Isocyanatotetrahydro-2H-pyran-4-yl)thiophene
4-(2-thienyl)-2H-3,4,5,6-tetrahydropyran-4-isocyanate
4-(Thien-2-yl)tetrahydro-2H-pyran-4-yl isocyanate
4-(Thien-2-yl)tetrahydro-2H-pyran-4-yl isocyanate, 2-(4-Isocyanatotetrahydro-2H-pyran-4-yl)thiophene
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 318.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.0±3.0 kJ/mol
Flash Point: 146.6±27.9 °C
Index of Refraction: 1.610
Molar Refractivity: 57.2±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 2.50
ACD/BCF (pH 5.5): 46.52
ACD/KOC (pH 5.5): 543.64
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 46.52
ACD/KOC (pH 7.4): 543.64
Polar Surface Area: 67 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 164.9±7.0 cm3

Click to predict properties on the Chemicalize site


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