ChemSpider 2D Image | 2-Benzylideneheptyl 3-methylbutanoate | C19H28O2

2-Benzylideneheptyl 3-methylbutanoate

  • Molecular FormulaC19H28O2
  • Average mass288.424 Da
  • Monoisotopic mass288.208923 Da
  • ChemSpider ID21105858

More details:

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

2-(Phenylmethylene)heptyl 3-methylbutanoate
2-Benzylideneheptyl 3-methylbutanoate [ACD/IUPAC Name]
2-Benzylidenheptyl-3-methylbutanoat [German] [ACD/IUPAC Name]
3-Méthylbutanoate de 2-benzylidèneheptyle [French] [ACD/IUPAC Name]
7493-80-3 [RN]
Butanoic acid, 3-methyl-, 2-(phenylmethylene)heptyl ester [ACD/Index Name]
α-Amyl-β-phenylacryl isovalerate
α-n-Amyl-β-phenylacryl 3-methylbutanoate
α-Pentylcinnamyl isovalerate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 393.3±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.3±3.0 kJ/mol
Flash Point: 123.0±20.4 °C
Index of Refraction: 1.514
Molar Refractivity: 90.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 6.71
ACD/LogD (pH 5.5): 6.26
ACD/BCF (pH 5.5): 34016.61
ACD/KOC (pH 5.5): 61005.42
ACD/LogD (pH 7.4): 6.26
ACD/BCF (pH 7.4): 34016.61
ACD/KOC (pH 7.4): 61005.42
Polar Surface Area: 26 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 34.8±3.0 dyne/cm
Molar Volume: 299.1±3.0 cm3

Click to predict properties on the Chemicalize site


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