ChemSpider 2D Image | 2-Hydroxy-4-methylthiazole-5-carboxylicacid | C5H5NO3S

2-Hydroxy-4-methylthiazole-5-carboxylicacid

  • Molecular FormulaC5H5NO3S
  • Average mass159.163 Da
  • Monoisotopic mass158.999008 Da
  • ChemSpider ID15205708

More details:

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

2-hydroxy-4-methylthiazole-5-carboxylic acid
2-Hydroxy-4-methylthiazole-5-carboxylicacid
4-Methyl-2-oxo-2,3-dihydro-1,3-thiazol-5-carbonsäure [German] [ACD/IUPAC Name]
4-Methyl-2-oxo-2,3-dihydro-1,3-thiazole-5-carboxylic acid [ACD/IUPAC Name]
4-methyl-2-oxo-2,3-dihydrothiazole-5-carboxylic acid
5-Thiazolecarboxylic acid, 2,3-dihydro-4-methyl-2-oxo- [ACD/Index Name]
875237-46-0 [RN]
Acide 4-méthyl-2-oxo-2,3-dihydro-1,3-thiazole-5-carboxylique [French] [ACD/IUPAC Name]
MFCD11904862 [MDL number]
[875237-46-0] [RN]
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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: 1.6±0.1 g/cm3
    Boiling Point: 435.9±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 73.0±3.0 kJ/mol
    Flash Point: 217.4±26.5 °C
    Index of Refraction: 1.653
    Molar Refractivity: 36.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 0.76
    ACD/LogD (pH 5.5): -2.39
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.76
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 99 Å2
    Polarizability: 14.4±0.5 10-24cm3
    Surface Tension: 82.4±3.0 dyne/cm
    Molar Volume: 99.4±3.0 cm3

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