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ChemSpider 2D Image | METHYL 2-AMINOBENZO[D]THIAZOLE-5-CARBOXYLATE | C9H8N2O2S

METHYL 2-AMINOBENZO[D]THIAZOLE-5-CARBOXYLATE

  • Molecular FormulaC9H8N2O2S
  • Average mass208.237 Da
  • Monoisotopic mass208.030655 Da
  • ChemSpider ID13360277

More details:

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

209459-07-4 [RN]
2-Amino-1,3-benzothiazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Benzothiazolecarboxylic acid, 2-amino-, methyl ester [ACD/Index Name]
Methyl 2-amino-1,3-benzothiazole-5-carboxylate [ACD/IUPAC Name]
METHYL 2-AMINOBENZO[D]THIAZOLE-5-CARBOXYLATE
Methyl-2-amino-1,3-benzothiazol-5-carboxylat [German] [ACD/IUPAC Name]
MFCD09263763 [MDL number]
[209459-07-4] [RN]
23616-33-3 [RN]
2-amino benzothiazole-5-carboxylic acid methyl ester
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: 378.4±34.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.6±3.0 kJ/mol
    Flash Point: 182.6±25.7 °C
    Index of Refraction: 1.700
    Molar Refractivity: 56.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.87
    ACD/LogD (pH 5.5): 1.69
    ACD/BCF (pH 5.5): 11.25
    ACD/KOC (pH 5.5): 196.59
    ACD/LogD (pH 7.4): 1.69
    ACD/BCF (pH 7.4): 11.28
    ACD/KOC (pH 7.4): 197.19
    Polar Surface Area: 93 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 67.1±3.0 dyne/cm
    Molar Volume: 146.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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