ChemSpider 2D Image | {2-[4-(5-Amino-3-methyl-1,2-oxazol-4-yl)-1H-1,2,3-triazol-1-yl]ethyl}phosphonic acid | C8H12N5O4P

{2-[4-(5-Amino-3-methyl-1,2-oxazol-4-yl)-1H-1,2,3-triazol-1-yl]ethyl}phosphonic acid

  • Molecular FormulaC8H12N5O4P
  • Average mass273.186 Da
  • Monoisotopic mass273.062683 Da
  • ChemSpider ID86686705

More details:

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

{2-[4-(5-Amino-3-methyl-1,2-oxazol-4-yl)-1H-1,2,3-triazol-1-yl]ethyl}phosphonic acid [ACD/IUPAC Name]
{2-[4-(5-Amino-3-methyl-1,2-oxazol-4-yl)-1H-1,2,3-triazol-1-yl]ethyl}phosphonsäure [German] [ACD/IUPAC Name]
Acide {2-[4-(5-amino-3-méthyl-1,2-oxazol-4-yl)-1H-1,2,3-triazol-1-yl]éthyl}phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [2-[4-(5-amino-3-methyl-4-isoxazolyl)-1H-1,2,3-triazol-1-yl]ethyl]- [ACD/Index Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 614.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 325.4±34.3 °C
Index of Refraction: 1.772
Molar Refractivity: 60.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.80
ACD/LogD (pH 5.5): -5.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 150 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 99.6±7.0 dyne/cm
Molar Volume: 144.1±7.0 cm3

Click to predict properties on the Chemicalize site


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