ChemSpider 2D Image | butadiynylallene | C7H4

butadiynylallene

  • Molecular FormulaC7H4
  • Average mass88.107 Da
  • Monoisotopic mass88.031303 Da
  • ChemSpider ID24771108

More details:

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

1,2-Heptadien-4,6-diin [German] [ACD/IUPAC Name]
1,2-Heptadiene-4,6-diyne [ACD/Index Name] [ACD/IUPAC Name]
1,2-Heptadiène-4,6-diyne [French] [ACD/IUPAC Name]
butadiynylallene
PA-789-80

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

Density: 0.8±0.1 g/cm3
Boiling Point: 126.3±13.0 °C at 760 mmHg
Vapour Pressure: 14.2±0.1 mmHg at 25°C
Enthalpy of Vaporization: 34.9±0.8 kJ/mol
Flash Point: 15.2±14.0 °C
Index of Refraction: 1.484
Molar Refractivity: 30.0±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.44
ACD/BCF (pH 5.5): 42.15
ACD/KOC (pH 5.5): 506.54
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 42.15
ACD/KOC (pH 7.4): 506.54
Polar Surface Area: 0 Å2
Polarizability: 11.9±0.5 10-24cm3
Surface Tension: 17.7±3.0 dyne/cm
Molar Volume: 104.9±3.0 cm3

Click to predict properties on the Chemicalize site


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