ChemSpider 2D Image | 1-Amino-3-[(2-bromo-5-methoxybenzyl)oxy]-2-propanol | C11H16BrNO3

1-Amino-3-[(2-bromo-5-methoxybenzyl)oxy]-2-propanol

  • Molecular FormulaC11H16BrNO3
  • Average mass290.154 Da
  • Monoisotopic mass289.031342 Da
  • ChemSpider ID35489880

More details:

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

1-Amino-3-[(2-brom-5-methoxybenzyl)oxy]-2-propanol [German] [ACD/IUPAC Name]
1-Amino-3-[(2-bromo-5-methoxybenzyl)oxy]-2-propanol [ACD/IUPAC Name]
1-Amino-3-[(2-bromo-5-méthoxybenzyl)oxy]-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-amino-3-[(2-bromo-5-methoxyphenyl)methoxy]- [ACD/Index Name]
1437436-12-8 [RN]
1-Amino-3-(2-bromo-5-methoxy-benzyloxy)-propan-2-ol
1-amino-3-[(2-bromo-5-methoxyphenyl)methoxy]propan-2-ol
MFCD24683162

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 419.3±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 70.9±3.0 kJ/mol
    Flash Point: 207.4±27.3 °C
    Index of Refraction: 1.565
    Molar Refractivity: 66.2±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 3
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.09
    ACD/LogD (pH 5.5): -1.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.32
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 8.16
    Polar Surface Area: 65 Å2
    Polarizability: 26.2±0.5 10-24cm3
    Surface Tension: 47.3±3.0 dyne/cm
    Molar Volume: 203.4±3.0 cm3

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