ChemSpider 2D Image | 1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3-formylthiourea | C6H10N2O3S2

1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3-formylthiourea

  • Molecular FormulaC6H10N2O3S2
  • Average mass222.285 Da
  • Monoisotopic mass222.013275 Da
  • ChemSpider ID35514026

More details:

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

1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3-formylthioharnstoff [German] [ACD/IUPAC Name]
1-(1,1-Dioxidotetrahydro-3-thiophenyl)-3-formylthiourea [ACD/IUPAC Name]
1-(1,1-Dioxydotétrahydro-3-thiophényl)-3-formylthiourée [French] [ACD/IUPAC Name]
Thiourea, N-formyl-N'-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
1935337-48-6 [RN]
MFCD28398559
n-(1,1-dioxidotetrahydro-3-thienyl)-n-formylthiourea
N-(1,1-dioxidotetrahydro-3-thienyl)-N'-formylthiourea
N-[(1,1-dioxothiolan-3-yl)carbamothioyl]formamide

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 449.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.8±3.0 kJ/mol
    Flash Point: 225.5±31.5 °C
    Index of Refraction: 1.610
    Molar Refractivity: 51.3±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -1.67
    ACD/LogD (pH 5.5): -1.41
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.05
    ACD/LogD (pH 7.4): -1.42
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 4.02
    Polar Surface Area: 116 Å2
    Polarizability: 20.4±0.5 10-24cm3
    Surface Tension: 71.4±5.0 dyne/cm
    Molar Volume: 148.1±5.0 cm3

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