ChemSpider 2D Image | 3-Chloro-2-(cyclopropylmethoxy)-5-fluorobenzonitrile | C11H9ClFNO

3-Chloro-2-(cyclopropylmethoxy)-5-fluorobenzonitrile

  • Molecular FormulaC11H9ClFNO
  • Average mass225.647 Da
  • Monoisotopic mass225.035675 Da
  • ChemSpider ID69058535

More details:

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

3-Chlor-2-(cyclopropylmethoxy)-5-fluorbenzonitril [German] [ACD/IUPAC Name]
3-Chloro-2-(cyclopropylmethoxy)-5-fluorobenzonitrile [ACD/IUPAC Name]
3-Chloro-2-(cyclopropylméthoxy)-5-fluorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 3-chloro-2-(cyclopropylmethoxy)-5-fluoro- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 328.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.1±3.0 kJ/mol
Flash Point: 152.6±26.5 °C
Index of Refraction: 1.555
Molar Refractivity: 54.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 3.12
ACD/BCF (pH 5.5): 139.16
ACD/KOC (pH 5.5): 1191.05
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 139.16
ACD/KOC (pH 7.4): 1191.05
Polar Surface Area: 33 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 47.4±5.0 dyne/cm
Molar Volume: 169.6±5.0 cm3

Click to predict properties on the Chemicalize site


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