ChemSpider 2D Image | [5-(2-Methyl-2-propanyl)-1,3,4-thiadiazol-2-yl]methanol | C7H12N2OS

[5-(2-Methyl-2-propanyl)-1,3,4-thiadiazol-2-yl]methanol

  • Molecular FormulaC7H12N2OS
  • Average mass172.248 Da
  • Monoisotopic mass172.067032 Da
  • ChemSpider ID34209636

More details:

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

[5-(2-Methyl-2-propanyl)-1,3,4-thiadiazol-2-yl]methanol [German] [ACD/IUPAC Name]
[5-(2-Methyl-2-propanyl)-1,3,4-thiadiazol-2-yl]methanol [ACD/IUPAC Name]
[5-(2-Méthyl-2-propanyl)-1,3,4-thiadiazol-2-yl]méthanol [French] [ACD/IUPAC Name]
1,3,4-Thiadiazole-2-methanol, 5-(1,1-dimethylethyl)- [ACD/Index Name]
(5-tert-butyl-[1,3,4]thiadiazol-2-yl)methanol
(5-tert-Butyl-[1,3,4]thiadiazol-2-yl)-methanol
(5-tert-butyl-1,3,4-thiadiazol-2-yl)methanol
1256240-31-9 [RN]
AGN-PC-0BZBWA
MFCD19981628
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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: 292.5±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 56.2±3.0 kJ/mol
    Flash Point: 130.7±22.6 °C
    Index of Refraction: 1.538
    Molar Refractivity: 45.7±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.46
    ACD/LogD (pH 5.5): 0.77
    ACD/BCF (pH 5.5): 2.28
    ACD/KOC (pH 5.5): 62.82
    ACD/LogD (pH 7.4): 0.77
    ACD/BCF (pH 7.4): 2.28
    ACD/KOC (pH 7.4): 62.82
    Polar Surface Area: 74 Å2
    Polarizability: 18.1±0.5 10-24cm3
    Surface Tension: 46.2±3.0 dyne/cm
    Molar Volume: 145.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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