ChemSpider 2D Image | 1-(Chloromethyl)cyclobutanecarbonitrile | C6H8ClN

1-(Chloromethyl)cyclobutanecarbonitrile

  • Molecular FormulaC6H8ClN
  • Average mass129.587 Da
  • Monoisotopic mass129.034531 Da
  • ChemSpider ID32988038

More details:

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

1-(Chlormethyl)cyclobutancarbonitril [German] [ACD/IUPAC Name]
1-(chloromethyl)cyclobutane-1-carbonitrile
1-(Chloromethyl)cyclobutanecarbonitrile [ACD/IUPAC Name]
1-(Chlorométhyl)cyclobutanecarbonitrile [French] [ACD/IUPAC Name]
869224-45-3 [RN]
Cyclobutanecarbonitrile, 1-(chloromethyl)- [ACD/Index Name]
MFCD19236686

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

Density: 1.1±0.1 g/cm3
Boiling Point: 226.3±13.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.3±3.0 kJ/mol
Flash Point: 96.6±14.8 °C
Index of Refraction: 1.479
Molar Refractivity: 32.6±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.92
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.33
ACD/KOC (pH 5.5): 210.16
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 12.33
ACD/KOC (pH 7.4): 210.16
Polar Surface Area: 24 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 38.0±5.0 dyne/cm
Molar Volume: 114.9±5.0 cm3

Click to predict properties on the Chemicalize site


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