ChemSpider 2D Image | 1,2-Dichloro-3-(2-isocyanatoethyl)benzene | C9H7Cl2NO

1,2-Dichloro-3-(2-isocyanatoethyl)benzene

  • Molecular FormulaC9H7Cl2NO
  • Average mass216.064 Da
  • Monoisotopic mass214.990463 Da
  • ChemSpider ID25999889

More details:

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

1,2-Dichlor-3-(2-isocyanatoethyl)benzol [German] [ACD/IUPAC Name]
1,2-Dichloro-3-(2-isocyanatoethyl)benzene [ACD/IUPAC Name]
1,2-Dichloro-3-(2-isocyanatoéthyl)benzène [French] [ACD/IUPAC Name]
73075-66-8 [RN]
Benzene, 1,2-dichloro-3-(2-isocyanatoethyl)- [ACD/Index Name]
MFCD16547715 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 297.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.7±3.0 kJ/mol
Flash Point: 109.6±13.8 °C
Index of Refraction: 1.557
Molar Refractivity: 54.6±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.91
ACD/BCF (pH 5.5): 556.59
ACD/KOC (pH 5.5): 3212.62
ACD/LogD (pH 7.4): 3.91
ACD/BCF (pH 7.4): 556.59
ACD/KOC (pH 7.4): 3212.62
Polar Surface Area: 29 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 41.5±7.0 dyne/cm
Molar Volume: 169.5±7.0 cm3

Click to predict properties on the Chemicalize site


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