ChemSpider 2D Image | Ethyl 4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylate | C10H13NO2S

Ethyl 4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylate

  • Molecular FormulaC10H13NO2S
  • Average mass211.281 Da
  • Monoisotopic mass211.066696 Da
  • ChemSpider ID23346846

More details:

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

1080026-94-3 [RN]
4,5,6,7-Tétrahydrothiéno[3,2-c]pyridine-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxylate [ACD/IUPAC Name]
Ethyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-carboxylat [German] [ACD/IUPAC Name]
Thieno[3,2-c]pyridine-2-carboxylic acid, 4,5,6,7-tetrahydro-, ethyl ester [ACD/Index Name]
[1080026-94-3] [RN]
2,5-dimethyl-1H-pyrazol-3-one
2,5-dimethyl-1H-pyrazol-3-one;1,3-Dimethyl-1H-pyrazol-5-ol
BR-24575
Ethyl 4,5,6,7-tetrahydrothieno-[3,2-c]pyridine-2-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 368.7±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.5±3.0 kJ/mol
    Flash Point: 176.8±27.9 °C
    Index of Refraction: 1.555
    Molar Refractivity: 56.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.52
    ACD/LogD (pH 5.5): -0.78
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 14.02
    Polar Surface Area: 67 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 44.1±3.0 dyne/cm
    Molar Volume: 176.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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