ChemSpider 2D Image | (2R)-1-(8-Bromo-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)-2-propanaminium | C13H17BrNO2

(2R)-1-(8-Bromo-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)-2-propanaminium

  • Molecular FormulaC13H17BrNO2
  • Average mass299.183 Da
  • Monoisotopic mass298.043701 Da
  • ChemSpider ID34975688

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-1-(8-Brom-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)-2-propanaminium [German] [ACD/IUPAC Name]
(2R)-1-(8-Bromo-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)-2-propanaminium [ACD/IUPAC Name]
(2R)-1-(8-Bromo-2,3,6,7-tétrahydrofuro[2,3-f][1]benzofuran-4-yl)-2-propanaminium [French] [ACD/IUPAC Name]
Benzo[1,2-b:4,5-b']difuran-4-ethanamine, 8-bromo-2,3,6,7-tetrahydro-α-methyl-, conjugate acid, (αR)- [ACD/Index Name]
CHEMBL6710

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

Density:
Boiling Point: 420.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.5±3.0 kJ/mol
Flash Point: 208.2±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.39
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.35
Polar Surface Area: 46 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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