ChemSpider 2D Image | 5-Chloro-6,6-difluoro-5-hexen-3-yn-2-one | C6H3ClF2O

5-Chloro-6,6-difluoro-5-hexen-3-yn-2-one

  • Molecular FormulaC6H3ClF2O
  • Average mass164.537 Da
  • Monoisotopic mass163.984055 Da
  • ChemSpider ID93571774

More details:

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

5-Chlor-6,6-difluor-5-hexen-3-in-2-on [German] [ACD/IUPAC Name]
5-Chloro-6,6-difluoro-5-hexen-3-yn-2-one [ACD/IUPAC Name]
5-Chloro-6,6-difluoro-5-hexén-3-yn-2-one [French] [ACD/IUPAC Name]
5-Hexen-3-yn-2-one, 5-chloro-6,6-difluoro- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 119.1±50.0 °C at 760 mmHg
Vapour Pressure: 16.2±0.2 mmHg at 25°C
Enthalpy of Vaporization: 35.7±3.0 kJ/mol
Flash Point: 25.8±30.1 °C
Index of Refraction: 1.444
Molar Refractivity: 32.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 20.66
ACD/KOC (pH 5.5): 304.06
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 20.66
ACD/KOC (pH 7.4): 304.06
Polar Surface Area: 17 Å2
Polarizability: 13.0±0.5 10-24cm3
Surface Tension: 30.9±3.0 dyne/cm
Molar Volume: 123.5±3.0 cm3

Click to predict properties on the Chemicalize site


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