ChemSpider 2D Image | 1-Isopropyl-5-indolinecarbonitrile | C12H14N2

1-Isopropyl-5-indolinecarbonitrile

  • Molecular FormulaC12H14N2
  • Average mass186.253 Da
  • Monoisotopic mass186.115692 Da
  • ChemSpider ID30660113

More details:

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

1H-Indole-5-carbonitrile, 2,3-dihydro-1-(1-methylethyl)- [ACD/Index Name]
1-Isopropyl-5-indolincarbonitril [German] [ACD/IUPAC Name]
1-Isopropyl-5-indolinecarbonitrile [ACD/IUPAC Name]
1-Isopropyl-5-indolinecarbonitrile [French] [ACD/IUPAC Name]
668467-78-5 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 333.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.6±3.0 kJ/mol
Flash Point: 145.2±15.2 °C
Index of Refraction: 1.576
Molar Refractivity: 56.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 100.07
ACD/KOC (pH 5.5): 933.45
ACD/LogD (pH 7.4): 2.95
ACD/BCF (pH 7.4): 102.76
ACD/KOC (pH 7.4): 958.60
Polar Surface Area: 27 Å2
Polarizability: 22.3±0.5 10-24cm3
Surface Tension: 46.7±5.0 dyne/cm
Molar Volume: 170.0±5.0 cm3

Click to predict properties on the Chemicalize site


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