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Search term: 62815751 (Found by CSID)
ChemSpider 2D Image | formyl octanoate | C9H16O3

formyl octanoate

  • Molecular FormulaC9H16O3
  • Average mass172.221 Da
  • Monoisotopic mass172.109940 Da
  • ChemSpider ID62815751

More details:

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

767292-01-3 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 233.5±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.0±3.0 kJ/mol
Flash Point: 92.1±19.8 °C
Index of Refraction: 1.427
Molar Refractivity: 45.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.03
ACD/KOC (pH 5.5): 772.68
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.03
ACD/KOC (pH 7.4): 772.68
Polar Surface Area: 43 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 32.2±3.0 dyne/cm
Molar Volume: 177.9±3.0 cm3

Click to predict properties on the Chemicalize site


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