ChemSpider 2D Image | (1-Cbz-3-piperidine)carbothioamide | C14H18N2O2S

(1-Cbz-3-piperidine)carbothioamide

  • Molecular FormulaC14H18N2O2S
  • Average mass278.370 Da
  • Monoisotopic mass278.108887 Da
  • ChemSpider ID22484453

More details:

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

(1-Cbz-3-piperidine)carbothioamide
1-Piperidinecarboxylic acid, 3-(aminothioxomethyl)-, phenylmethyl ester [ACD/Index Name]
3-Carbamothioyl-1-pipéridinecarboxylate de benzyle [French] [ACD/IUPAC Name]
569348-15-8 [RN]
Benzyl 3-carbamothioyl-1-piperidinecarboxylate [ACD/IUPAC Name]
benzyl 3-carbamothioylpiperidine-1-carboxylate
Benzyl-3-carbamothioyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
[569348-15-8] [RN]
1-Cbz-piperidine-3-thiocarboxamide
MFCD11223487 [MDL number]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 441.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.9±3.0 kJ/mol
    Flash Point: 221.1±31.5 °C
    Index of Refraction: 1.614
    Molar Refractivity: 77.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.73
    ACD/LogD (pH 5.5): 2.13
    ACD/BCF (pH 5.5): 24.61
    ACD/KOC (pH 5.5): 344.63
    ACD/LogD (pH 7.4): 2.13
    ACD/BCF (pH 7.4): 24.61
    ACD/KOC (pH 7.4): 344.66
    Polar Surface Area: 88 Å2
    Polarizability: 30.7±0.5 10-24cm3
    Surface Tension: 61.0±3.0 dyne/cm
    Molar Volume: 222.1±3.0 cm3

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