ChemSpider 2D Image | (S)-BENZYL 3-FORMYLPIPERIDINE-1-CARBOXYLATE | C14H17NO3

(S)-BENZYL 3-FORMYLPIPERIDINE-1-CARBOXYLATE

  • Molecular FormulaC14H17NO3
  • Average mass247.290 Da
  • Monoisotopic mass247.120850 Da
  • ChemSpider ID29362705

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Formyl-1-pipéridinecarboxylate de benzyle [French] [ACD/IUPAC Name]
(S)-BENZYL 3-FORMYLPIPERIDINE-1-CARBOXYLATE
1-Piperidinecarboxylic acid, 3-formyl-, phenylmethyl ester, (3S)- [ACD/Index Name]
405063-39-0 [RN]
Benzyl (3S)-3-formyl-1-piperidinecarboxylate [ACD/IUPAC Name]
Benzyl-(3S)-3-formyl-1-piperidincarboxylat [German] [ACD/IUPAC Name]
1-Cbz-piperidine-3-aldehyde
201478-72-0 [RN]
Benzyl (3S)-3-formylpiperidine-1-carboxylate
DS-10384
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 384.5±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.3±3.0 kJ/mol
    Flash Point: 186.3±27.9 °C
    Index of Refraction: 1.594
    Molar Refractivity: 68.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.83
    ACD/LogD (pH 5.5): 2.23
    ACD/BCF (pH 5.5): 29.43
    ACD/KOC (pH 5.5): 391.71
    ACD/LogD (pH 7.4): 2.23
    ACD/BCF (pH 7.4): 29.43
    ACD/KOC (pH 7.4): 391.71
    Polar Surface Area: 47 Å2
    Polarizability: 27.2±0.5 10-24cm3
    Surface Tension: 55.9±3.0 dyne/cm
    Molar Volume: 202.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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