ChemSpider 2D Image | 2-[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]propanoic acid | C14H20N2O3S

2-[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]propanoic acid

  • Molecular FormulaC14H20N2O3S
  • Average mass296.385 Da
  • Monoisotopic mass296.119476 Da
  • ChemSpider ID21801616

More details:

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

1142210-17-0 [RN]
2-[1-(2,4-dimethyl-1,3-thiazole-5-carbonyl)piperidin-4-yl]propanoic acid
2-{1-[(2,4-Dimethyl-1,3-thiazol-5-yl)carbonyl]-4-piperidinyl}propanoic acid [ACD/IUPAC Name]
2-{1-[(2,4-Dimethyl-1,3-thiazol-5-yl)carbonyl]-4-piperidinyl}propansäure [German] [ACD/IUPAC Name]
2-{1-[(2,4-dimethyl-1,3-thiazol-5-yl)carbonyl]piperidin-4-yl}propanoic acid
4-Piperidineacetic acid, 1-[(2,4-dimethyl-5-thiazolyl)carbonyl]-α-methyl- [ACD/Index Name]
Acide 2-{1-[(2,4-diméthyl-1,3-thiazol-5-yl)carbonyl]-4-pipéridinyl}propanoïque [French] [ACD/IUPAC Name]
[1142210-17-0] [RN]
2-(1-(2,4-dimethylthiazole-5-carbonyl)piperidin-4-yl)propanoic acid
2-(1-[(2,4-DIMETHYL-1,3-THIAZOL-5-YL)CARBONYL]PIPERIDIN-4-YL)PROPANOIC ACID
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD12028295 [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: 507.8±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 81.9±3.0 kJ/mol
    Flash Point: 260.9±25.9 °C
    Index of Refraction: 1.572
    Molar Refractivity: 77.8±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.39
    ACD/LogD (pH 5.5): 0.24
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 12.50
    ACD/LogD (pH 7.4): -1.56
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 99 Å2
    Polarizability: 30.9±0.5 10-24cm3
    Surface Tension: 54.1±3.0 dyne/cm
    Molar Volume: 236.5±3.0 cm3

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