ChemSpider 2D Image | (2E)-4,4-Dimethyl-2-pentenenitrile | C7H11N

(2E)-4,4-Dimethyl-2-pentenenitrile

  • Molecular FormulaC7H11N
  • Average mass109.169 Da
  • Monoisotopic mass109.089149 Da
  • ChemSpider ID62971149

More details:

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

(2E)-4,4-Dimethyl-2-pentenenitrile [ACD/IUPAC Name]
(2E)-4,4-Diméthyl-2-pentènenitrile [French] [ACD/IUPAC Name]
(2E)-4,4-Dimethyl-2-pentennitril [German] [ACD/IUPAC Name]
2-Pentenenitrile, 4,4-dimethyl-, (2E)- [ACD/Index Name]
39168-14-4 [RN]

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

Density: 0.8±0.1 g/cm3
Boiling Point: 156.5±9.0 °C at 760 mmHg
Vapour Pressure: 2.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.3±3.0 kJ/mol
Flash Point: 47.7±11.2 °C
Index of Refraction: 1.438
Molar Refractivity: 34.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 2.05
ACD/BCF (pH 5.5): 21.20
ACD/KOC (pH 5.5): 309.71
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.20
ACD/KOC (pH 7.4): 309.71
Polar Surface Area: 24 Å2
Polarizability: 13.6±0.5 10-24cm3
Surface Tension: 27.9±3.0 dyne/cm
Molar Volume: 131.1±3.0 cm3

Click to predict properties on the Chemicalize site


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