ChemSpider 2D Image | 1,3,7-Octatrien-5-yne | C8H8

1,3,7-Octatrien-5-yne

  • Molecular FormulaC8H8
  • Average mass104.149 Da
  • Monoisotopic mass104.062599 Da
  • ChemSpider ID24591401

More details:

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

1,3,7-Octatrien-5-in [German] [ACD/IUPAC Name]
1,3,7-Octatrien-5-yne [ACD/Index Name] [ACD/IUPAC Name]
1,3,7-Octatrién-5-yne [French] [ACD/IUPAC Name]
Octa-1,3,7-trien-5-yne
16607-77-5 [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: 139.0±9.0 °C at 760 mmHg
Vapour Pressure: 8.2±0.1 mmHg at 25°C
Enthalpy of Vaporization: 36.1±0.8 kJ/mol
Flash Point: 24.6±12.9 °C
Index of Refraction: 1.485
Molar Refractivity: 36.6±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 75.42
ACD/KOC (pH 5.5): 768.28
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 75.42
ACD/KOC (pH 7.4): 768.28
Polar Surface Area: 0 Å2
Polarizability: 14.5±0.5 10-24cm3
Surface Tension: 28.0±3.0 dyne/cm
Molar Volume: 127.7±3.0 cm3

Click to predict properties on the Chemicalize site


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