ChemSpider 2D Image | 2-(4-Methyl-1,3-thiazol-5-yl)ethyl phosphate | C6H8NO4PS

2-(4-Methyl-1,3-thiazol-5-yl)ethyl phosphate

  • Molecular FormulaC6H8NO4PS
  • Average mass221.172 Da
  • Monoisotopic mass220.992264 Da
  • ChemSpider ID24785144

  • Charge - Charge

More details:

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

2-(4-Methyl-1,3-thiazol-5-yl)ethyl phosphate [ACD/IUPAC Name]
2-(4-Methyl-1,3-thiazol-5-yl)ethylphosphat [German] [ACD/IUPAC Name]
5-Thiazoleethanol, 4-methyl-, dihydrogen phosphate (ester), ion(2-) [ACD/Index Name]
Phosphate de 2-(4-méthyl-1,3-thiazol-5-yl)éthyle [French] [ACD/IUPAC Name]
4-4-methyl-5-(2-phosphonooxyethyl)-thiazole
4-methyl-5-(&β;-hydroxyethyl)thiazole phosphate
4-Methyl-5-(2-phosphoethyl)-thiazole
4-methyl-5-(2-phosphonatooxyethyl)thiazole
4-methyl-5-(2-phosphonatooxyethyl)thiazole dianion
4-methyl-5-(2-phosphonatooxyethyl)thiazole(2-)
More...
  • Miscellaneous

    • Chemical Class:

      An organophosphate oxoanion arising from deprotonation of the phosphate OH groups of 4-methyl-5-(2-phosphonooxyethyl)thiazole; major species at pH 7.3. ChEBI CHEBI:58296

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

Density:
Boiling Point: 437.3±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.1±3.0 kJ/mol
Flash Point: 218.3±29.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.72
ACD/LogD (pH 5.5): -3.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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