ChemSpider 2D Image | 6-[Bromo(1-isobutylcyclopentyl)methyl]chromane | C19H27BrO

6-[Bromo(1-isobutylcyclopentyl)methyl]chromane

  • Molecular FormulaC19H27BrO
  • Average mass351.321 Da
  • Monoisotopic mass350.124512 Da
  • ChemSpider ID36808121

More details:

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

2H-1-Benzopyran, 6-[bromo[1-(2-methylpropyl)cyclopentyl]methyl]-3,4-dihydro- [ACD/Index Name]
6-[Brom(1-isobutylcyclopentyl)methyl]chroman [German] [ACD/IUPAC Name]
6-[Bromo(1-isobutylcyclopentyl)methyl]chromane [ACD/IUPAC Name]
6-[Bromo(1-isobutylcyclopentyl)méthyl]chromane [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 415.4±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.3±3.0 kJ/mol
Flash Point: 160.5±24.0 °C
Index of Refraction: 1.553
Molar Refractivity: 92.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.39
ACD/LogD (pH 5.5): 6.91
ACD/BCF (pH 5.5): 105459.24
ACD/KOC (pH 5.5): 137120.56
ACD/LogD (pH 7.4): 6.91
ACD/BCF (pH 7.4): 105459.24
ACD/KOC (pH 7.4): 137120.56
Polar Surface Area: 9 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 288.2±3.0 cm3

Click to predict properties on the Chemicalize site


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