ChemSpider 2D Image | [4-(Difluoromethyl)-1-naphthyl]acetonitrile | C13H9F2N

[4-(Difluoromethyl)-1-naphthyl]acetonitrile

  • Molecular FormulaC13H9F2N
  • Average mass217.214 Da
  • Monoisotopic mass217.070313 Da
  • ChemSpider ID57360866

More details:

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

[4-(Difluormethyl)-1-naphthyl]acetonitril [German] [ACD/IUPAC Name]
[4-(Difluoromethyl)-1-naphthyl]acetonitrile [ACD/IUPAC Name]
[4-(Difluorométhyl)-1-naphtyl]acétonitrile [French] [ACD/IUPAC Name]
1-(Difluoromethyl)naphthalene-4-acetonitrile
1261660-94-9 [RN]
1-Naphthaleneacetonitrile, 4-(difluoromethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 365.2±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.1±3.0 kJ/mol
Flash Point: 174.6±26.5 °C
Index of Refraction: 1.576
Molar Refractivity: 58.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.05
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 402.69
ACD/KOC (pH 5.5): 2548.24
ACD/LogD (pH 7.4): 3.73
ACD/BCF (pH 7.4): 402.69
ACD/KOC (pH 7.4): 2548.24
Polar Surface Area: 24 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 177.7±3.0 cm3

Click to predict properties on the Chemicalize site


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