ChemSpider 2D Image | 4-(Dimethylphosphoryl)-5-(methoxycarbonyl)-1,2-thiazole-3-carboxylic acid | C8H10NO5PS

4-(Dimethylphosphoryl)-5-(methoxycarbonyl)-1,2-thiazole-3-carboxylic acid

  • Molecular FormulaC8H10NO5PS
  • Average mass263.207 Da
  • Monoisotopic mass263.001740 Da
  • ChemSpider ID98512436

More details:

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

3,5-Isothiazoledicarboxylic acid, 4-(dimethylphosphinyl)-, 5-methyl ester [ACD/Index Name]
4-(Dimethylphosphoryl)-5-(methoxycarbonyl)-1,2-thiazol-3-carbonsäure [German] [ACD/IUPAC Name]
4-(Dimethylphosphoryl)-5-(methoxycarbonyl)-1,2-thiazole-3-carboxylic acid [ACD/IUPAC Name]
Acide 4-(diméthylphosphoryl)-5-(méthoxycarbonyl)-1,2-thiazole-3-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: 450.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.8±3.0 kJ/mol
Flash Point: 226.3±28.7 °C
Index of Refraction: 1.542
Molar Refractivity: 56.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.81
ACD/LogD (pH 5.5): -2.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 61.9±5.0 dyne/cm
Molar Volume: 178.2±5.0 cm3

Click to predict properties on the Chemicalize site


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