ChemSpider 2D Image | 2,2,5-Trimethyl-4-heptanone | C10H20O

2,2,5-Trimethyl-4-heptanone

  • Molecular FormulaC10H20O
  • Average mass156.265 Da
  • Monoisotopic mass156.151413 Da
  • ChemSpider ID52119002

More details:

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

2,2,5-Trimethyl-4-heptanon [German] [ACD/IUPAC Name]
2,2,5-Trimethyl-4-heptanone [ACD/IUPAC Name]
2,2,5-Triméthyl-4-heptanone [French] [ACD/IUPAC Name]
4-Heptanone, 2,2,5-trimethyl- [ACD/Index Name]

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

Density: 0.8±0.1 g/cm3
Boiling Point: 181.4±8.0 °C at 760 mmHg
Vapour Pressure: 0.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 41.8±3.0 kJ/mol
Flash Point: 46.8±12.1 °C
Index of Refraction: 1.420
Molar Refractivity: 48.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.01
ACD/LogD (pH 5.5): 3.02
ACD/BCF (pH 5.5): 116.07
ACD/KOC (pH 5.5): 1046.02
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 116.07
ACD/KOC (pH 7.4): 1046.02
Polar Surface Area: 17 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 25.0±3.0 dyne/cm
Molar Volume: 191.1±3.0 cm3

Click to predict properties on the Chemicalize site


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