ChemSpider 2D Image | (5-Benzyl-3-furyl)methyl (1S,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate | C20H20Br2O3

(5-Benzyl-3-furyl)methyl (1S,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate

  • Molecular FormulaC20H20Br2O3
  • Average mass468.179 Da
  • Monoisotopic mass465.977905 Da
  • ChemSpider ID34991504

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,3R)-3-(2,2-Dibromovinyl)-2,2-diméthylcyclopropanecarboxylate de (5-benzyl-3-furyl)méthyle [French] [ACD/IUPAC Name]
(5-Benzyl-3-furyl)methyl (1S,3R)-3-(2,2-dibromovinyl)-2,2-dimethylcyclopropanecarboxylate [ACD/IUPAC Name]
(5-Benzyl-3-furyl)methyl-(1S,3R)-3-(2,2-dibromvinyl)-2,2-dimethylcyclopropancarboxylat [German] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 3-(2,2-dibromoethenyl)-2,2-dimethyl-, [5-(phenylmethyl)-3-furanyl]methyl ester, (1S,3R)- [ACD/Index Name]
42789-03-7 [RN]
Bromethrin
UNII-IX5R90QY2A

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

Density: 1.6±0.1 g/cm3
Boiling Point: 470.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.3±3.0 kJ/mol
Flash Point: 238.1±28.7 °C
Index of Refraction: 1.635
Molar Refractivity: 106.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.24
ACD/LogD (pH 5.5): 6.38
ACD/BCF (pH 5.5): 41339.48
ACD/KOC (pH 5.5): 70141.79
ACD/LogD (pH 7.4): 6.38
ACD/BCF (pH 7.4): 41339.48
ACD/KOC (pH 7.4): 70141.79
Polar Surface Area: 39 Å2
Polarizability: 42.3±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 297.7±3.0 cm3

Click to predict properties on the Chemicalize site


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