ChemSpider 2D Image | 2-(Dimethylamino)-3-(4-methylphenyl)-3H-thieno[2,3-d]imidazole-5-carboxylic acid | C15H15N3O2S

2-(Dimethylamino)-3-(4-methylphenyl)-3H-thieno[2,3-d]imidazole-5-carboxylic acid

  • Molecular FormulaC15H15N3O2S
  • Average mass301.363 Da
  • Monoisotopic mass301.088501 Da
  • ChemSpider ID21763778

More details:

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

1000932-46-6 [RN]
2-(Dimethylamino)-3-(4-methylphenyl)-3H-thieno[2,3-d]imidazol-5-carbonsäure [German] [ACD/IUPAC Name]
2-(Dimethylamino)-3-(4-methylphenyl)-3H-thieno[2,3-d]imidazole-5-carboxylic acid [ACD/IUPAC Name]
3H-Thieno[2,3-d]imidazole-5-carboxylic acid, 2-(dimethylamino)-3-(4-methylphenyl)- [ACD/Index Name]
Acide 2-(diméthylamino)-3-(4-méthylphényl)-3H-thiéno[2,3-d]imidazole-5-carboxylique [French] [ACD/IUPAC Name]
[1000932-46-6] [RN]
2-(dimethylamino)-3-(4-methylphenyl)thieno[2,3-d]imidazole-5-carboxylic acid
2-(dimethylamino)-3-(p-tolyl)-3H-thieno[2,3-d]imidazole-5-carboxylic acid
2-Dimethylamino-3-p-tolyl-3H-thieno[2,3-d]imidazole-5-carboxylic acid
BS-5449
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 511.9±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 82.4±3.0 kJ/mol
    Flash Point: 263.4±32.9 °C
    Index of Refraction: 1.683
    Molar Refractivity: 84.0±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 4.66
    ACD/LogD (pH 5.5): 1.64
    ACD/BCF (pH 5.5): 2.62
    ACD/KOC (pH 5.5): 13.59
    ACD/LogD (pH 7.4): 1.48
    ACD/BCF (pH 7.4): 1.80
    ACD/KOC (pH 7.4): 9.34
    Polar Surface Area: 87 Å2
    Polarizability: 33.3±0.5 10-24cm3
    Surface Tension: 52.4±7.0 dyne/cm
    Molar Volume: 221.3±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement