ChemSpider 2D Image | S-(5-Bromo-2-formylphenyl) dimethylcarbamothioate | C10H10BrNO2S

S-(5-Bromo-2-formylphenyl) dimethylcarbamothioate

  • Molecular FormulaC10H10BrNO2S
  • Average mass288.161 Da
  • Monoisotopic mass286.961548 Da
  • ChemSpider ID30507799

More details:

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

1624260-49-6 [RN]
Carbamothioic acid, N,N-dimethyl-, S-(5-bromo-2-formylphenyl) ester [ACD/Index Name]
Diméthylcarbamothioate de S-(5-bromo-2-formylphényle) [French] [ACD/IUPAC Name]
S-(5-Brom-2-formylphenyl)-dimethylcarbamothioat [German] [ACD/IUPAC Name]
S-(5-Bromo-2-formylphenyl) dimethylcarbamothioate [ACD/IUPAC Name]
MFCD27501040 [MDL number]
S-(5-bromo-2-formylphenyl) N,N-dimethylcarbamothioate

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 380.3±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.8±3.0 kJ/mol
    Flash Point: 183.8±30.7 °C
    Index of Refraction: 1.631
    Molar Refractivity: 65.3±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.56
    ACD/LogD (pH 5.5): 2.29
    ACD/BCF (pH 5.5): 32.09
    ACD/KOC (pH 5.5): 416.75
    ACD/LogD (pH 7.4): 2.29
    ACD/BCF (pH 7.4): 32.09
    ACD/KOC (pH 7.4): 416.75
    Polar Surface Area: 63 Å2
    Polarizability: 25.9±0.5 10-24cm3
    Surface Tension: 57.9±5.0 dyne/cm
    Molar Volume: 183.4±5.0 cm3

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