ChemSpider 2D Image | 4-(4H-1,2,4-Triazol-4-yl)piperidine | C7H12N4

4-(4H-1,2,4-Triazol-4-yl)piperidine

  • Molecular FormulaC7H12N4
  • Average mass152.197 Da
  • Monoisotopic mass152.106201 Da
  • ChemSpider ID24196252

More details:

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

4-(4H-1,2,4-Triazol-4-yl)piperidin [German] [ACD/IUPAC Name]
4-(4H-1,2,4-Triazol-4-yl)piperidine [ACD/IUPAC Name]
4-(4H-1,2,4-Triazol-4-yl)pipéridine [French] [ACD/IUPAC Name]
690261-92-8 [RN]
Piperidine, 4-(4H-1,2,4-triazol-4-yl)- [ACD/Index Name]
4-(1,2,4-triazol-4-yl)piperidine
4-(4H-1,2,4-triazol-4-yl)-Piperidine
DS-5053
MFCD10698546 [MDL number]
Piperidine, 4-(4H-1,2,4-triazol-4-yl)- (9CI)
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 306.7±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 54.7±3.0 kJ/mol
    Flash Point: 139.3±30.7 °C
    Index of Refraction: 1.682
    Molar Refractivity: 42.8±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.66
    ACD/LogD (pH 5.5): -3.36
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.38
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 43 Å2
    Polarizability: 17.0±0.5 10-24cm3
    Surface Tension: 55.5±7.0 dyne/cm
    Molar Volume: 113.0±7.0 cm3

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