ChemSpider 2D Image | 6-Bromo-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid | C10H10BrNO2

6-Bromo-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid

  • Molecular FormulaC10H10BrNO2
  • Average mass256.096 Da
  • Monoisotopic mass254.989487 Da
  • ChemSpider ID26546990

More details:

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

1260643-32-0 [RN]
1-Isoquinolinecarboxylic acid, 6-bromo-1,2,3,4-tetrahydro- [ACD/Index Name]
6-Brom-1,2,3,4-tetrahydro-1-isochinolincarbonsäure [German] [ACD/IUPAC Name]
6-Bromo-1,2,3,4-tetrahydro-1-isoquinolinecarboxylic acid [ACD/IUPAC Name]
6-bromo-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid
Acide 6-bromo-1,2,3,4-tétrahydro-1-isoquinoléinecarboxylique [French] [ACD/IUPAC Name]
[1260643-32-0] [RN]
1260644-50-5 [RN]
1390664-92-2 [RN]
1390705-75-5 [RN]
More...

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 415.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 70.5±3.0 kJ/mol
    Flash Point: 205.1±28.7 °C
    Index of Refraction: 1.608
    Molar Refractivity: 55.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.31
    ACD/LogD (pH 5.5): -0.88
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.89
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 49 Å2
    Polarizability: 22.0±0.5 10-24cm3
    Surface Tension: 52.2±3.0 dyne/cm
    Molar Volume: 160.7±3.0 cm3

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