ChemSpider 2D Image | 3-Hydroxy-1,2-thiazole-5-carbaldehyde | C4H3NO2S

3-Hydroxy-1,2-thiazole-5-carbaldehyde

  • Molecular FormulaC4H3NO2S
  • Average mass129.137 Da
  • Monoisotopic mass128.988449 Da
  • ChemSpider ID45532118

More details:

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

3-Hydroxy-1,2-thiazol-5-carbaldehyd [German] [ACD/IUPAC Name]
3-Hydroxy-1,2-thiazole-5-carbaldehyde [ACD/IUPAC Name]
3-Hydroxy-1,2-thiazole-5-carbaldéhyde [French] [ACD/IUPAC Name]
5-Isothiazolecarboxaldehyde, 3-hydroxy- [ACD/Index Name]
300768-06-3 [RN]
MFCD24684101

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 150.1±33.0 °C at 760 mmHg
Vapour Pressure: 3.1±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.3±3.0 kJ/mol
Flash Point: 44.5±25.4 °C
Index of Refraction: 1.688
Molar Refractivity: 31.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.16
ACD/LogD (pH 5.5): 0.32
ACD/BCF (pH 5.5): 1.02
ACD/KOC (pH 5.5): 35.25
ACD/LogD (pH 7.4): 0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.29
Polar Surface Area: 78 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 78.3±3.0 dyne/cm
Molar Volume: 82.2±3.0 cm3

Click to predict properties on the Chemicalize site


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