ChemSpider 2D Image | Hydroxy[1-(2-phosphonoethyl)-1H-1,2,3-triazol-4-yl]acetic acid | C6H10N3O6P

Hydroxy[1-(2-phosphonoethyl)-1H-1,2,3-triazol-4-yl]acetic acid

  • Molecular FormulaC6H10N3O6P
  • Average mass251.134 Da
  • Monoisotopic mass251.030716 Da
  • ChemSpider ID88679910

More details:

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

1H-1,2,3-Triazole-4-acetic acid, α-hydroxy-1-(2-phosphonoethyl)- [ACD/Index Name]
Acide hydroxy[1-(2-phosphonoéthyl)-1H-1,2,3-triazol-4-yl]acétique [French] [ACD/IUPAC Name]
Hydroxy[1-(2-phosphonoethyl)-1H-1,2,3-triazol-4-yl]acetic acid [ACD/IUPAC Name]
Hydroxy[1-(2-phosphonoethyl)-1H-1,2,3-triazol-4-yl]essigsäure [German] [ACD/IUPAC Name]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 660.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.2±3.0 kJ/mol
Flash Point: 353.5±34.3 °C
Index of Refraction: 1.725
Molar Refractivity: 49.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -3.61
ACD/LogD (pH 5.5): -7.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 156 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 116.6±7.0 dyne/cm
Molar Volume: 125.1±7.0 cm3

Click to predict properties on the Chemicalize site


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