ChemSpider 2D Image | 5-Chloro-5-hexen-2-ynal | C6H5ClO

5-Chloro-5-hexen-2-ynal

  • Molecular FormulaC6H5ClO
  • Average mass128.556 Da
  • Monoisotopic mass128.002899 Da
  • ChemSpider ID60822331

More details:

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

5-Chlor-5-hexen-2-inal [German] [ACD/IUPAC Name]
5-Chloro-5-hexen-2-ynal [ACD/IUPAC Name]
5-Chloro-5-hexén-2-ynal [French] [ACD/IUPAC Name]
5-Hexen-2-ynal, 5-chloro- [ACD/Index Name]
596823-30-2 [RN]
MFCD24686485

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

Density: 1.1±0.1 g/cm3
Boiling Point: 203.5±33.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.0±3.0 kJ/mol
Flash Point: 80.0±26.0 °C
Index of Refraction: 1.479
Molar Refractivity: 32.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.94
ACD/LogD (pH 5.5): 2.27
ACD/BCF (pH 5.5): 31.28
ACD/KOC (pH 5.5): 409.23
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 31.28
ACD/KOC (pH 7.4): 409.23
Polar Surface Area: 17 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 114.5±3.0 cm3

Click to predict properties on the Chemicalize site


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