ChemSpider 2D Image | N-[2-(5-tert-butyl-1H-1,2,4-triazol-3-yl)ethyl]-4-chloroaniline | C14H19ClN4

N-[2-(5-tert-butyl-1H-1,2,4-triazol-3-yl)ethyl]-4-chloroaniline

  • Molecular FormulaC14H19ClN4
  • Average mass278.780 Da
  • Monoisotopic mass278.129822 Da
  • ChemSpider ID29374722

More details:

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

1279203-88-1 [RN]
1H-1,2,4-Triazole-3-ethanamine, N-(4-chlorophenyl)-5-(1,1-dimethylethyl)- [ACD/Index Name]
4-Chlor-N-{2-[3-(2-methyl-2-propanyl)-1H-1,2,4-triazol-5-yl]ethyl}anilin [German] [ACD/IUPAC Name]
4-Chloro-N-{2-[3-(2-methyl-2-propanyl)-1H-1,2,4-triazol-5-yl]ethyl}aniline [ACD/IUPAC Name]
4-Chloro-N-{2-[3-(2-méthyl-2-propanyl)-1H-1,2,4-triazol-5-yl]éthyl}aniline [French] [ACD/IUPAC Name]
N-[2-(5-tert-butyl-1H-1,2,4-triazol-3-yl)ethyl]-4-chloroaniline
[2-(5-tert-Butyl-1H-[1,2,4]triazol-3-yl)-ethyl]-(4-chloro-phenyl)-amine
AGN-PC-09OZE2
AKOS005188459
MFCD18784790
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 500.4±56.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.9±3.0 kJ/mol
    Flash Point: 256.4±31.8 °C
    Index of Refraction: 1.603
    Molar Refractivity: 78.9±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.91
    ACD/LogD (pH 5.5): 3.06
    ACD/BCF (pH 5.5): 122.28
    ACD/KOC (pH 5.5): 1072.60
    ACD/LogD (pH 7.4): 3.07
    ACD/BCF (pH 7.4): 127.54
    ACD/KOC (pH 7.4): 1118.76
    Polar Surface Area: 54 Å2
    Polarizability: 31.3±0.5 10-24cm3
    Surface Tension: 49.9±3.0 dyne/cm
    Molar Volume: 229.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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