ChemSpider 2D Image | 3-Hexen-1-yl 2-methylpropanoate | C10H18O2

3-Hexen-1-yl 2-methylpropanoate

  • Molecular FormulaC10H18O2
  • Average mass170.249 Da
  • Monoisotopic mass170.130676 Da
  • ChemSpider ID21161776

More details:

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

260-993-3 [EINECS]
2-Méthylpropanoate de 3-hexén-1-yle [French] [ACD/IUPAC Name]
3-Hexen-1-yl 2-methylpropanoate [ACD/IUPAC Name]
3-Hexen-1-yl-2-methylpropanoat [German] [ACD/IUPAC Name]
57859-47-9 [RN]
Hex-3-en-1-yl 2-methylpropanoate
Propanoic acid, 2-methyl-, 3-hexen-1-yl ester [ACD/Index Name]
(3Z)-Hex-3-enyl isobutyrate [ACD/IUPAC Name]
41519-23-7 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 211.5±19.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.8±3.0 kJ/mol
Flash Point: 75.0±19.9 °C
Index of Refraction: 1.438
Molar Refractivity: 50.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 2.95
ACD/BCF (pH 5.5): 103.75
ACD/KOC (pH 5.5): 965.28
ACD/LogD (pH 7.4): 2.95
ACD/BCF (pH 7.4): 103.75
ACD/KOC (pH 7.4): 965.28
Polar Surface Area: 26 Å2
Polarizability: 19.9±0.5 10-24cm3
Surface Tension: 27.9±3.0 dyne/cm
Molar Volume: 191.1±3.0 cm3

Click to predict properties on the Chemicalize site


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