ChemSpider 2D Image | 4-(Chloromethyl)-4-hydroxy-1,1-dimethoxy-3-hexanone | C9H17ClO4

4-(Chloromethyl)-4-hydroxy-1,1-dimethoxy-3-hexanone

  • Molecular FormulaC9H17ClO4
  • Average mass224.682 Da
  • Monoisotopic mass224.081543 Da
  • ChemSpider ID74028466

More details:

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

3-Hexanone, 4-(chloromethyl)-4-hydroxy-1,1-dimethoxy- [ACD/Index Name]
4-(Chlormethyl)-4-hydroxy-1,1-dimethoxy-3-hexanon [German] [ACD/IUPAC Name]
4-(Chloromethyl)-4-hydroxy-1,1-dimethoxy-3-hexanone [ACD/IUPAC Name]
4-(Chlorométhyl)-4-hydroxy-1,1-diméthoxy-3-hexanone [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 313.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.3±6.0 kJ/mol
Flash Point: 143.5±27.9 °C
Index of Refraction: 1.458
Molar Refractivity: 53.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.04
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 5.28
ACD/KOC (pH 5.5): 114.50
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.28
ACD/KOC (pH 7.4): 114.49
Polar Surface Area: 56 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 36.5±3.0 dyne/cm
Molar Volume: 196.3±3.0 cm3

Click to predict properties on the Chemicalize site


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