ChemSpider 2D Image | 4-Chloro-3,5-heptanedione | C7H11ClO2

4-Chloro-3,5-heptanedione

  • Molecular FormulaC7H11ClO2
  • Average mass162.614 Da
  • Monoisotopic mass162.044754 Da
  • ChemSpider ID10623529

More details:

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

13054-81-4 [RN]
3,5-Heptanedione, 4-chloro- [ACD/Index Name]
4-Chlor-3,5-heptandion [German] [ACD/IUPAC Name]
4-Chloro-3,5-heptanedione [ACD/IUPAC Name]
4-Chloro-3,5-heptanedione [French] [ACD/IUPAC Name]
"4-CHLOROHEPTANE-3,5-DIONE"
4-Chloroheptane-3,5-dione
MFCD08277631

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

Density: 1.1±0.1 g/cm3
Boiling Point: 206.1±20.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.2±3.0 kJ/mol
Flash Point: 81.3±22.3 °C
Index of Refraction: 1.437
Molar Refractivity: 39.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.70
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.35
ACD/KOC (pH 5.5): 228.62
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 1.96
ACD/KOC (pH 7.4): 31.27
Polar Surface Area: 34 Å2
Polarizability: 15.6±0.5 10-24cm3
Surface Tension: 31.9±3.0 dyne/cm
Molar Volume: 150.1±3.0 cm3

Click to predict properties on the Chemicalize site


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