ChemSpider 2D Image | CHEMBRDG-BB 4004239 | C10H10O2S

CHEMBRDG-BB 4004239

  • Molecular FormulaC10H10O2S
  • Average mass194.250 Da
  • Monoisotopic mass194.040146 Da
  • ChemSpider ID21612659

More details:

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

2-Thiophenecarboxaldehyde, 5-(3-hydroxy-3-methyl-1-butyn-1-yl)- [ACD/Index Name]
5-(3-Hydroxy-3-methyl-1-butin-1-yl)-2-thiophencarbaldehyd [German] [ACD/IUPAC Name]
5-(3-Hydroxy-3-methyl-1-butyn-1-yl)-2-thiophenecarbaldehyde [ACD/IUPAC Name]
5-(3-Hydroxy-3-méthyl-1-butyn-1-yl)-2-thiophènecarbaldéhyde [French] [ACD/IUPAC Name]
5-(3-Hydroxy-3-methyl-1-butyn-1-yl)-2-thiophenecarboxaldehyde
5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophene-2-carbaldehyde
915921-21-0 [RN]
CHEMBRDG-BB 4004239
[915921-21-0] [RN]
5-(3-hydroxy-3-methylbut-1-ynyl)thiophene-2-carbaldehyde
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 350.5±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.8±3.0 kJ/mol
    Flash Point: 165.8±26.5 °C
    Index of Refraction: 1.585
    Molar Refractivity: 52.6±0.4 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.82
    ACD/LogD (pH 5.5): 1.74
    ACD/BCF (pH 5.5): 12.38
    ACD/KOC (pH 5.5): 210.73
    ACD/LogD (pH 7.4): 1.74
    ACD/BCF (pH 7.4): 12.38
    ACD/KOC (pH 7.4): 210.73
    Polar Surface Area: 66 Å2
    Polarizability: 20.8±0.5 10-24cm3
    Surface Tension: 54.8±5.0 dyne/cm
    Molar Volume: 156.8±5.0 cm3

    Click to predict properties on the Chemicalize site


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