ChemSpider 2D Image | Butyl 2-octenoate | C12H22O2

Butyl 2-octenoate

  • Molecular FormulaC12H22O2
  • Average mass198.302 Da
  • Monoisotopic mass198.161987 Da
  • ChemSpider ID21161755

More details:

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

260-720-8 [EINECS]
2-Octénoate de butyle [French] [ACD/IUPAC Name]
2-Octenoic acid, butyl ester [ACD/Index Name]
57403-32-4 [RN]
Butyl 2-octenoate [ACD/IUPAC Name]
Butyl oct-2-enoate
Butyl-2-octenoat [German] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 254.9±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 118.8±6.2 °C
Index of Refraction: 1.444
Molar Refractivity: 59.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.04
ACD/LogD (pH 5.5): 4.28
ACD/BCF (pH 5.5): 1060.12
ACD/KOC (pH 5.5): 5095.06
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 1060.12
ACD/KOC (pH 7.4): 5095.06
Polar Surface Area: 26 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 29.5±3.0 dyne/cm
Molar Volume: 223.7±3.0 cm3

Click to predict properties on the Chemicalize site


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