ChemSpider 2D Image | 1-(9-Bromo-3,6,7,8-tetrahydro-2H-furo[2,3-g]chromen-4-yl)-2-propanamine | C14H18BrNO2

1-(9-Bromo-3,6,7,8-tetrahydro-2H-furo[2,3-g]chromen-4-yl)-2-propanamine

  • Molecular FormulaC14H18BrNO2
  • Average mass312.202 Da
  • Monoisotopic mass311.052094 Da
  • ChemSpider ID24718288

More details:

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

1-(9-Brom-3,6,7,8-tetrahydro-2H-furo[2,3-g]chromen-4-yl)-2-propanamin [German] [ACD/IUPAC Name]
1-(9-Bromo-3,6,7,8-tetrahydro-2H-furo[2,3-g]chromen-4-yl)-2-propanamine [ACD/IUPAC Name]
1-(9-Bromo-3,6,7,8-tétrahydro-2H-furo[2,3-g]chromén-4-yl)-2-propanamine [French] [ACD/IUPAC Name]
2H-Furo[2,3-g][1]benzopyran-4-ethanamine, 9-bromo-3,6,7,8-tetrahydro-α-methyl- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL520133/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 437.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 218.1±28.7 °C
Index of Refraction: 1.603
Molar Refractivity: 74.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.22
ACD/LogD (pH 7.4): 1.17
ACD/BCF (pH 7.4): 1.47
ACD/KOC (pH 7.4): 11.91
Polar Surface Area: 44 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 217.0±3.0 cm3

Click to predict properties on the Chemicalize site


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