ChemSpider 2D Image | 1-PROPANONE, 3-DIMETHYLAMINO-1-(3-THIENYL)- | C9H13NOS

1-PROPANONE, 3-DIMETHYLAMINO-1-(3-THIENYL)-

  • Molecular FormulaC9H13NOS
  • Average mass183.271 Da
  • Monoisotopic mass183.071777 Da
  • ChemSpider ID19250325

More details:

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

100860-96-6 [RN]
1-Propanone, 3-(dimethylamino)-1-(3-thienyl)- [ACD/Index Name]
1-PROPANONE, 3-DIMETHYLAMINO-1-(3-THIENYL)-
3-(Dimethylamino)-1-(3-thienyl)-1-propanon [German] [ACD/IUPAC Name]
3-(Dimethylamino)-1-(3-thienyl)-1-propanone [ACD/IUPAC Name]
3-(Diméthylamino)-1-(3-thiényl)-1-propanone [French] [ACD/IUPAC Name]
1-Propanone,3-(dimethylamino)-1-(3-thienyl)-
3-(Dimethylamino)-1-(thiophen-3-yl)propan-1-one
3-(dimethylamino)-1-thiophen-3-ylpropan-1-one
3-DIMETHYLAMINO-1-(3-THIENYL)-1-PROPANONE
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 273.3±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 51.2±3.0 kJ/mol
    Flash Point: 119.1±21.8 °C
    Index of Refraction: 1.538
    Molar Refractivity: 52.3±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.52
    ACD/LogD (pH 5.5): -1.58
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.04
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 5.77
    Polar Surface Area: 49 Å2
    Polarizability: 20.7±0.5 10-24cm3
    Surface Tension: 40.0±3.0 dyne/cm
    Molar Volume: 167.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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