ChemSpider 2D Image | [(2E)-4-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-buten-1-yl]phosphonic acid | C8H11N2O5P

[(2E)-4-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-buten-1-yl]phosphonic acid

  • Molecular FormulaC8H11N2O5P
  • Average mass246.157 Da
  • Monoisotopic mass246.040558 Da
  • ChemSpider ID26390046

  • Double-bond stereo - Double-bond stereo

More details:

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

[(2E)-4-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-buten-1-yl]phosphonic acid [ACD/IUPAC Name]
[(2E)-4-(2,4-Dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-buten-1-yl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [(2E)-4-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2-butén-1-yl]phosphonique [French] [ACD/IUPAC Name]
Phosphonic acid, [(2E)-4-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-2-buten-1-yl]- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.574
Molar Refractivity: 53.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.54
ACD/LogD (pH 5.5): -5.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 117 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 66.7±3.0 dyne/cm
Molar Volume: 163.2±3.0 cm3

Click to predict properties on the Chemicalize site


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