ChemSpider 2D Image | tert-butyl 2-bromo-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridine-5-carboxylate | C11H15BrN2O2S

tert-butyl 2-bromo-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridine-5-carboxylate

  • Molecular FormulaC11H15BrN2O2S
  • Average mass319.218 Da
  • Monoisotopic mass318.003754 Da
  • ChemSpider ID24746091

More details:

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

1253654-37-3 [RN]
2-Bromo-6,7-dihydro[1,3]thiazolo[4,5-c]pyridine-5(4H)-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-bromo-6,7-dihydro[1,3]thiazolo[4,5-c]pyridine-5(4H)-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-brom-6,7-dihydro[1,3]thiazolo[4,5-c]pyridin-5(4H)-carboxylat [German] [ACD/IUPAC Name]
tert-butyl 2-bromo-4H,5H,6H,7H-[1,3]thiazolo[4,5-c]pyridine-5-carboxylate
Thiazolo[4,5-c]pyridine-5(4H)-carboxylic acid, 2-bromo-6,7-dihydro-, 1,1-dimethylethyl ester [ACD/Index Name]
[1253654-37-3] [RN]
2-Bromo-6,7-dihydro-4H-thiazolo[4,5-c]pyridine-5-carboxylic acid tert-butyl ester
3-methoxyisoquinolin-5-amine
95%
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 390.9±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.0±3.0 kJ/mol
    Flash Point: 190.2±27.9 °C
    Index of Refraction: 1.580
    Molar Refractivity: 71.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.73
    ACD/LogD (pH 5.5): 3.22
    ACD/BCF (pH 5.5): 165.99
    ACD/KOC (pH 5.5): 1351.28
    ACD/LogD (pH 7.4): 3.22
    ACD/BCF (pH 7.4): 166.00
    ACD/KOC (pH 7.4): 1351.31
    Polar Surface Area: 71 Å2
    Polarizability: 28.1±0.5 10-24cm3
    Surface Tension: 51.8±3.0 dyne/cm
    Molar Volume: 213.4±3.0 cm3

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