ChemSpider 2D Image | 3-Chloro-1-cyclopentene-1-carbonitrile | C6H6ClN

3-Chloro-1-cyclopentene-1-carbonitrile

  • Molecular FormulaC6H6ClN
  • Average mass127.572 Da
  • Monoisotopic mass127.018875 Da
  • ChemSpider ID48216800

More details:

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

1-Cyclopentene-1-carbonitrile, 3-chloro- [ACD/Index Name]
3-Chlor-1-cyclopenten-1-carbonitril [German] [ACD/IUPAC Name]
3-Chloro-1-cyclopentene-1-carbonitrile [ACD/IUPAC Name]
3-Chloro-1-cyclopentène-1-carbonitrile [French] [ACD/IUPAC Name]
1498016-89-9 [RN]
3-chlorocyclopent-1-ene-1-carbonitrile
MFCD21184668

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

Density: 1.2±0.1 g/cm3
Boiling Point: 233.9±39.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.1±3.0 kJ/mol
Flash Point: 105.3±22.1 °C
Index of Refraction: 1.507
Molar Refractivity: 32.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.08
ACD/LogD (pH 5.5): 1.48
ACD/BCF (pH 5.5): 7.79
ACD/KOC (pH 5.5): 151.34
ACD/LogD (pH 7.4): 1.48
ACD/BCF (pH 7.4): 7.79
ACD/KOC (pH 7.4): 151.34
Polar Surface Area: 24 Å2
Polarizability: 12.8±0.5 10-24cm3
Surface Tension: 39.2±5.0 dyne/cm
Molar Volume: 108.3±5.0 cm3

Click to predict properties on the Chemicalize site


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