ChemSpider 2D Image | tert-Butyl 4-(benzo[d]thiazol-2-yloxy)piperidine-1-carboxylate | C17H22N2O3S

tert-Butyl 4-(benzo[d]thiazol-2-yloxy)piperidine-1-carboxylate

  • Molecular FormulaC17H22N2O3S
  • Average mass334.433 Da
  • Monoisotopic mass334.135101 Da
  • ChemSpider ID28303838

More details:

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

1353985-53-1 [RN]
1-Piperidinecarboxylic acid, 4-(2-benzothiazolyloxy)-, 1,1-dimethylethyl ester [ACD/Index Name]
2-Methyl-2-propanyl 4-(1,3-benzothiazol-2-yloxy)-1-piperidinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-(1,3-benzothiazol-2-yloxy)-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-(1,3-Benzothiazol-2-yloxy)-1-pipéridinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
tert-Butyl 4-(benzo[d]thiazol-2-yloxy)piperidine-1-carboxylate
4-(Benzothiazol-2-yloxy)piperidine-1-carboxylic acid tert-butyl ester
4-(Benzothiazol-2-yloxy)-piperidine-1-carboxylic acid tert-butyl ester
MFCD21098864 [MDL number]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 448.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 70.7±3.0 kJ/mol
    Flash Point: 225.0±31.5 °C
    Index of Refraction: 1.595
    Molar Refractivity: 92.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 4.19
    ACD/LogD (pH 5.5): 3.82
    ACD/BCF (pH 5.5): 471.24
    ACD/KOC (pH 5.5): 2851.52
    ACD/LogD (pH 7.4): 3.82
    ACD/BCF (pH 7.4): 471.36
    ACD/KOC (pH 7.4): 2852.26
    Polar Surface Area: 80 Å2
    Polarizability: 36.5±0.5 10-24cm3
    Surface Tension: 51.7±3.0 dyne/cm
    Molar Volume: 271.0±3.0 cm3

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