ChemSpider 2D Image | 2-{[(4-Bromo-2-thienyl)methyl]amino}-2-methyl-1-propanol | C9H14BrNOS

2-{[(4-Bromo-2-thienyl)methyl]amino}-2-methyl-1-propanol

  • Molecular FormulaC9H14BrNOS
  • Average mass264.183 Da
  • Monoisotopic mass262.997925 Da
  • ChemSpider ID21857383

More details:

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

1-Propanol, 2-[[(4-bromo-2-thienyl)methyl]amino]-2-methyl- [ACD/Index Name]
2-{[(4-Brom-2-thienyl)methyl]amino}-2-methyl-1-propanol [German] [ACD/IUPAC Name]
2-{[(4-Bromo-2-thienyl)methyl]amino}-2-methyl-1-propanol [ACD/IUPAC Name]
2-{[(4-Bromo-2-thiényl)méthyl]amino}-2-méthyl-1-propanol [French] [ACD/IUPAC Name]
2-{[(4-Bromo-2-thienyl)methyl]amino}-2-methylpropan-1-ol
1039925-03-5 [RN]
2-[(4-bromothiophen-2-yl)methylamino]-2-methylpropan-1-ol
2-[(4-Bromo-thiophen-2-ylmethyl)-amino]-2-methyl-propan-1-ol
2-{[(4-bromothiophen-2-yl)methyl]amino}-2-methylpropan-1-ol

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 356.8±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 63.5±3.0 kJ/mol
    Flash Point: 169.6±25.1 °C
    Index of Refraction: 1.577
    Molar Refractivity: 60.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.22
    ACD/LogD (pH 5.5): 0.34
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.08
    ACD/LogD (pH 7.4): 1.99
    ACD/BCF (pH 7.4): 15.17
    ACD/KOC (pH 7.4): 184.76
    Polar Surface Area: 61 Å2
    Polarizability: 24.1±0.5 10-24cm3
    Surface Tension: 45.2±3.0 dyne/cm
    Molar Volume: 183.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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