ChemSpider 2D Image | (6-Bromo-1'H,4H-spiro[1,3-benzodioxine-2,4'-piperidin]-1'-yl)methanol | C13H16BrNO3

(6-Bromo-1'H,4H-spiro[1,3-benzodioxine-2,4'-piperidin]-1'-yl)methanol

  • Molecular FormulaC13H16BrNO3
  • Average mass314.175 Da
  • Monoisotopic mass313.031342 Da
  • ChemSpider ID26328733

More details:






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

(6-Brom-1'H,4H-spiro[1,3-benzodioxine-2,4'-piperidin]-1'-yl)methanol [German] [ACD/IUPAC Name]
(6-Bromo-1'H,4H-spiro[1,3-benzodioxine-2,4'-piperidin]-1'-yl)methanol [ACD/IUPAC Name]
(6-Bromo-1'H,4H-spiro[1,3-benzodioxine-2,4'-piperidin]-1'-yl)méthanol [French] [ACD/IUPAC Name]
Spiro[4H-1,3-benzodioxin-2,4'-piperidine]-1'-methanol, 6-bromo- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 440.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 219.9±28.7 °C
Index of Refraction: 1.649
Molar Refractivity: 71.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.25
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 6.47
ACD/KOC (pH 5.5): 50.32
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 141.70
ACD/KOC (pH 7.4): 1102.14
Polar Surface Area: 42 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 63.0±5.0 dyne/cm
Molar Volume: 196.9±5.0 cm3

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