ChemSpider 2D Image | 2,2-Dimethyl-3-phenylpentanoate | C13H17O2

2,2-Dimethyl-3-phenylpentanoate

  • Molecular FormulaC13H17O2
  • Average mass205.273 Da
  • Monoisotopic mass205.123398 Da
  • ChemSpider ID21105992

  • Charge - Charge

More details:

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

2,2-Dimethyl-3-phenylpentanoat [German] [ACD/IUPAC Name]
2,2-Dimethyl-3-phenylpentanoate [ACD/IUPAC Name]
2,2-Diméthyl-3-phénylpentanoate [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-ethyl-α,α-dimethyl-, ion(1-) [ACD/Index Name]
2-Phenylpropyl-2-methylpropanoate
2-Phenylpropylisobutyrate
Hydrocinnamyl isobutyrate

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

Density:
Boiling Point: 308.4±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.0±3.0 kJ/mol
Flash Point: 205.5±14.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 44.23
ACD/KOC (pH 5.5): 307.75
ACD/LogD (pH 7.4): 0.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.92
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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