ChemSpider 2D Image | 4-Methyl-2-(methyldisulfanyl)-1,3-thiazole-5-carboxylic acid | C6H7NO2S3

4-Methyl-2-(methyldisulfanyl)-1,3-thiazole-5-carboxylic acid

  • Molecular FormulaC6H7NO2S3
  • Average mass221.320 Da
  • Monoisotopic mass220.963882 Da
  • ChemSpider ID49844443

More details:

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

4-Methyl-2-(methyldisulfanyl)-1,3-thiazol-5-carbonsäure [German] [ACD/IUPAC Name]
4-Methyl-2-(methyldisulfanyl)-1,3-thiazole-5-carboxylic acid [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 4-methyl-2-(methyldithio)- [ACD/Index Name]
Acide 4-méthyl-2-(méthyldisulfanyl)-1,3-thiazole-5-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 426.0±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 211.5±26.5 °C
Index of Refraction: 1.676
Molar Refractivity: 54.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.95
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 77.3±5.0 dyne/cm
Molar Volume: 144.2±5.0 cm3

Click to predict properties on the Chemicalize site


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