ChemSpider 2D Image | 1-Isocyanato-1-methylcyclobutane | C6H9NO

1-Isocyanato-1-methylcyclobutane

  • Molecular FormulaC6H9NO
  • Average mass111.142 Da
  • Monoisotopic mass111.068413 Da
  • ChemSpider ID42207712

More details:

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

1-Isocyanato-1-methylcyclobutan [German] [ACD/IUPAC Name]
1-Isocyanato-1-methylcyclobutane [ACD/IUPAC Name]
1-Isocyanato-1-méthylcyclobutane [French] [ACD/IUPAC Name]
Cyclobutane, 1-isocyanato-1-methyl- [ACD/Index Name]
MFCD32268198

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

Density: 1.0±0.1 g/cm3
Boiling Point: 124.1±9.0 °C at 760 mmHg
Vapour Pressure: 13.0±0.2 mmHg at 25°C
Enthalpy of Vaporization: 36.2±3.0 kJ/mol
Flash Point: 32.9±21.3 °C
Index of Refraction: 1.510
Molar Refractivity: 31.9±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 2.15
ACD/BCF (pH 5.5): 25.48
ACD/KOC (pH 5.5): 353.30
ACD/LogD (pH 7.4): 2.15
ACD/BCF (pH 7.4): 25.48
ACD/KOC (pH 7.4): 353.30
Polar Surface Area: 29 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 37.4±7.0 dyne/cm
Molar Volume: 106.7±7.0 cm3

Click to predict properties on the Chemicalize site


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