ChemSpider 2D Image | (1,1-~2~H_2_)-3-Buten-1-ol | C4H6D2O

(1,1-2H2)-3-Buten-1-ol

  • Molecular FormulaC4H6D2O
  • Average mass74.118 Da
  • Monoisotopic mass74.070068 Da
  • ChemSpider ID57618510

  • Non-standard isotope - Non-standard isotope

More details:

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

(1,1-2H2)-3-Buten-1-ol [German] [ACD/IUPAC Name]
(1,1-2H2)-3-Buten-1-ol [ACD/IUPAC Name]
(1,1-2H2)-3-Butén-1-ol [French] [ACD/IUPAC Name]
3-Buten-1,1-d2-1-ol [ACD/Index Name]
18932-23-5 [RN]
3-buten-1-ol-1,1-d2

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

Density: 0.8±0.1 g/cm3
Boiling Point: 113.5±0.0 °C at 760 mmHg
Vapour Pressure: 10.6±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.0±6.0 kJ/mol
Flash Point: 32.2±0.0 °C
Index of Refraction: 1.415
Molar Refractivity: 21.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.56
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.33
ACD/KOC (pH 5.5): 42.61
ACD/LogD (pH 7.4): 0.46
ACD/BCF (pH 7.4): 1.33
ACD/KOC (pH 7.4): 42.61
Polar Surface Area: 20 Å2
Polarizability: 8.7±0.5 10-24cm3
Surface Tension: 26.1±3.0 dyne/cm
Molar Volume: 87.2±3.0 cm3

Click to predict properties on the Chemicalize site


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