ChemSpider 2D Image | 3-Ethoxy-4-methylpentanoic acid | C8H16O3

3-Ethoxy-4-methylpentanoic acid

  • Molecular FormulaC8H16O3
  • Average mass160.211 Da
  • Monoisotopic mass160.109940 Da
  • ChemSpider ID28542779

More details:

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

3-Ethoxy-4-methylpentanoic acid [ACD/IUPAC Name]
3-Ethoxy-4-methylpentansäure [German] [ACD/IUPAC Name]
Acide 3-éthoxy-4-méthylpentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 3-ethoxy-4-methyl- [ACD/Index Name]
1394040-27-7 [RN]
MFCD22375339

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

Density: 1.0±0.1 g/cm3
Boiling Point: 237.8±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 52.3±6.0 kJ/mol
Flash Point: 87.2±16.1 °C
Index of Refraction: 1.435
Molar Refractivity: 42.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.05
ACD/LogD (pH 7.4): -1.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 47 Å2
Polarizability: 16.8±0.5 10-24cm3
Surface Tension: 32.2±3.0 dyne/cm
Molar Volume: 162.3±3.0 cm3

Click to predict properties on the Chemicalize site


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