ChemSpider 2D Image | 5-(1-aminoethyl)-1h-1,2,4-triazole-3-acetic acid | C6H10N4O2

5-(1-aminoethyl)-1h-1,2,4-triazole-3-acetic acid

  • Molecular FormulaC6H10N4O2
  • Average mass170.169 Da
  • Monoisotopic mass170.080383 Da
  • ChemSpider ID23076121

More details:

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

[3-(1-Aminoethyl)-1H-1,2,4-triazol-5-yl]acetic acid [ACD/IUPAC Name]
[3-(1-Aminoethyl)-1H-1,2,4-triazol-5-yl]essigsäure [German] [ACD/IUPAC Name]
2-[5-(1-aminoethyl)-4H-1,2,4-triazol-3-yl]acetic acid
4H-1,2,4-Triazole-3-acetic acid, 5-(1-aminoethyl)- [ACD/Index Name]
5-(1-aminoethyl)-1h-1,2,4-triazole-3-acetic acid
951625-86-8 [RN]
Acide [3-(1-aminoéthyl)-1H-1,2,4-triazol-5-yl]acétique [French] [ACD/IUPAC Name]
[5-(1-aminoethyl)-4H-1,2,4-triazol-3-yl]acetic acid
1H-1,2,4-TRIAZOLE-3-ACETIC ACID, 5-(1-AMINOETHYL)-
1h-1,2,4-triazole-3-acetic acid,5-(1-aminoethyl)-
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 464.9±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.5±3.0 kJ/mol
    Flash Point: 235.0±24.6 °C
    Index of Refraction: 1.607
    Molar Refractivity: 41.1±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 4
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -1.23
    ACD/LogD (pH 5.5): -3.46
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.62
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 105 Å2
    Polarizability: 16.3±0.5 10-24cm3
    Surface Tension: 82.1±3.0 dyne/cm
    Molar Volume: 118.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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