ChemSpider 2D Image | (2Z)-3-Bromo-2-buten-2-yl phenylacetate | C12H13BrO2

(2Z)-3-Bromo-2-buten-2-yl phenylacetate

  • Molecular FormulaC12H13BrO2
  • Average mass269.134 Da
  • Monoisotopic mass268.009888 Da
  • ChemSpider ID30688742

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-Brom-2-buten-2-yl-phenylacetat [German] [ACD/IUPAC Name]
(2Z)-3-Bromo-2-buten-2-yl phenylacetate [ACD/IUPAC Name]
Benzeneacetic acid, (1Z)-2-bromo-1-methyl-1-propen-1-yl ester [ACD/Index Name]
Phénylacétate de (2Z)-3-bromo-2-butén-2-yle [French] [ACD/IUPAC Name]
3-BROMOBUT-2-EN-2-YL 2-PHENYLACETATE
81214-87-1 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 314.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.5±3.0 kJ/mol
Flash Point: 143.9±25.9 °C
Index of Refraction: 1.555
Molar Refractivity: 63.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 532.99
ACD/KOC (pH 5.5): 3114.52
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 532.99
ACD/KOC (pH 7.4): 3114.52
Polar Surface Area: 26 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 198.2±3.0 cm3

Click to predict properties on the Chemicalize site


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