ChemSpider 2D Image | 1-Butatrienol | C4H4O

1-Butatrienol

  • Molecular FormulaC4H4O
  • Average mass68.074 Da
  • Monoisotopic mass68.026215 Da
  • ChemSpider ID61000607

More details:

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

1,2,3-Butatrien-1-ol [ACD/Index Name]
1-Butatrienol [German] [ACD/IUPAC Name]
1-Butatrienol [ACD/IUPAC Name]
1-Butatriénol [French] [ACD/IUPAC Name]
1823347-21-2 [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: 160.3±13.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.6 mmHg at 25°C
Enthalpy of Vaporization: 46.2±6.0 kJ/mol
Flash Point: 67.6±12.8 °C
Index of Refraction: 1.430
Molar Refractivity: 21.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.53
ACD/LogD (pH 5.5): 0.55
ACD/BCF (pH 5.5): 1.54
ACD/KOC (pH 5.5): 47.52
ACD/LogD (pH 7.4): 0.55
ACD/BCF (pH 7.4): 1.54
ACD/KOC (pH 7.4): 47.52
Polar Surface Area: 20 Å2
Polarizability: 8.6±0.5 10-24cm3
Surface Tension: 3.3±3.0 dyne/cm
Molar Volume: 84.5±3.0 cm3

Click to predict properties on the Chemicalize site


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