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ChemSpider 2D Image | Cyclobutylideneacetonitrile | C6H7N


  • Molecular FormulaC6H7N
  • Average mass93.127 Da
  • Monoisotopic mass93.057846 Da
  • ChemSpider ID24751218

More details:

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

Acetonitrile, 2-cyclobutylidene- [ACD/Index Name]
Cyclobutylidenacetonitril [German] [ACD/IUPAC Name]
Cyclobutylideneacetonitrile [ACD/IUPAC Name]
Cyclobutylidèneacétonitrile [French] [ACD/IUPAC Name]
27784-69-6 [RN]
Chemistry 4895
MFCD12963766 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 182.1±9.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.8±3.0 kJ/mol
Flash Point: 63.4±11.2 °C
Index of Refraction: 1.636
Molar Refractivity: 29.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 7.16
ACD/KOC (pH 5.5): 142.48
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 7.16
ACD/KOC (pH 7.4): 142.48
Polar Surface Area: 24 Å2
Polarizability: 11.6±0.5 10-24cm3
Surface Tension: 67.6±3.0 dyne/cm
Molar Volume: 81.6±3.0 cm3

Click to predict properties on the Chemicalize site