ChemSpider 2D Image | 2-Methyl-1,3-thiazole-5-sulfinic acid | C4H5NO2S2

2-Methyl-1,3-thiazole-5-sulfinic acid

  • Molecular FormulaC4H5NO2S2
  • Average mass163.218 Da
  • Monoisotopic mass162.976166 Da
  • ChemSpider ID61088738

More details:

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

2-Methyl-1,3-thiazol-5-sulfinsäure [German] [ACD/IUPAC Name]
2-Methyl-1,3-thiazole-5-sulfinic acid [ACD/IUPAC Name]
5-Thiazolesulfinic acid, 2-methyl- [ACD/Index Name]
Acide 2-méthyl-1,3-thiazole-5-sulfinique [French] [ACD/IUPAC Name]
1858873-04-7 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 395.8±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.1±3.0 kJ/mol
Flash Point: 193.2±25.7 °C
Index of Refraction: 1.707
Molar Refractivity: 37.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.83
ACD/LogD (pH 5.5): -3.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 108.0±5.0 dyne/cm
Molar Volume: 96.9±5.0 cm3

Click to predict properties on the Chemicalize site


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