ChemSpider 2D Image | 6-(3-Phosphonopropyl)-1,4,5,6-tetrahydro-4-pyrimidinecarboxylic acid | C8H15N2O5P

6-(3-Phosphonopropyl)-1,4,5,6-tetrahydro-4-pyrimidinecarboxylic acid

  • Molecular FormulaC8H15N2O5P
  • Average mass250.189 Da
  • Monoisotopic mass250.071854 Da
  • ChemSpider ID23157930

More details:

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

4-Pyrimidinecarboxylic acid, 3,4,5,6-tetrahydro-6-(3-phosphonopropyl)- [ACD/Index Name]
6-(3-Phosphonopropyl)-1,4,5,6-tetrahydro-4-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
6-(3-Phosphonopropyl)-1,4,5,6-tetrahydro-4-pyrimidinecarboxylic acid [ACD/IUPAC Name]
6-(3-phosphonopropyl)-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
Acide 6-(3-phosphonopropyl)-1,4,5,6-tétrahydro-4-pyrimidinecarboxylique [French] [ACD/IUPAC Name]
6-(3-Phosphono-propyl)-3,4,5,6-tetrahydro-pyrimidine-4-carboxylic acid

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

Density: 1.7±0.1 g/cm3
Boiling Point: 655.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.3 mmHg at 25°C
Enthalpy of Vaporization: 105.2±6.0 kJ/mol
Flash Point: 350.0±34.3 °C
Index of Refraction: 1.645
Molar Refractivity: 54.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -2.91
ACD/LogD (pH 5.5): -5.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 129 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 81.7±7.0 dyne/cm
Molar Volume: 149.2±7.0 cm3

Click to predict properties on the Chemicalize site


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