ChemSpider 2D Image | 1-(Bromomethyl)-4'-(2-methyl-2-propanyl)-3-oxaspiro[bicyclo[3.1.0]hexane-2,1'-cyclohexane] | C15H25BrO

1-(Bromomethyl)-4'-(2-methyl-2-propanyl)-3-oxaspiro[bicyclo[3.1.0]hexane-2,1'-cyclohexane]

  • Molecular FormulaC15H25BrO
  • Average mass301.262 Da
  • Monoisotopic mass300.108856 Da
  • ChemSpider ID71111345

More details:

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

1-(Bromomethyl)-4'-(2-methyl-2-propanyl)-3-oxaspiro[bicyclo[3.1.0]hexane-2,1'-cyclohexane] [ACD/IUPAC Name]
Spiro[cyclohexane-1,2'-[3]oxabicyclo[3.1.0]hexane], 1'-(bromomethyl)-4-(1,1-dimethylethyl)- [ACD/Index Name]
1-(bromomethyl)-4'-tert-butyl-3-oxaspiro[bicyclo[3.1.0]hexane-2,1'-cyclohexane]
2172167-63-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 345.7±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.6±3.0 kJ/mol
Flash Point: 135.6±21.5 °C
Index of Refraction: 1.531
Molar Refractivity: 74.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 4.92
ACD/BCF (pH 5.5): 3252.54
ACD/KOC (pH 5.5): 11366.94
ACD/LogD (pH 7.4): 4.92
ACD/BCF (pH 7.4): 3252.54
ACD/KOC (pH 7.4): 11366.94
Polar Surface Area: 9 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 38.0±5.0 dyne/cm
Molar Volume: 241.7±5.0 cm3

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