ChemSpider 2D Image | 5-(3-Phenyl-1,2,4-oxadiazol-5-yl)-4(1H)-pyrimidinone | C12H8N4O2

5-(3-Phenyl-1,2,4-oxadiazol-5-yl)-4(1H)-pyrimidinone

  • Molecular FormulaC12H8N4O2
  • Average mass240.217 Da
  • Monoisotopic mass240.064728 Da
  • ChemSpider ID24792653

More details:

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

1215535-02-6 [RN]
4-Pyrimidinol, 5-(3-phenyl-1,2,4-oxadiazol-5-yl)- [ACD/Index Name]
5-(3-phenyl-1,2,4-oxadiazol-5-yl)-3,4-dihydropyrimidin-4-one
5-(3-Phenyl-1,2,4-oxadiazol-5-yl)-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
5-(3-Phenyl-1,2,4-oxadiazol-5-yl)-4(1H)-pyrimidinone [ACD/IUPAC Name]
5-(3-Phényl-1,2,4-oxadiazol-5-yl)-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
[1215535-02-6] [RN]
5-(3-phenyl-1,2,4-oxadiazol-5-yl)-3H-pyrimidin-4-one
5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4(3H)-one
5-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrimidin-4-ol
More...

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

[1215535-02-06] [DBID]
1215535-02-06 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 468.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 237.3±31.5 °C
Index of Refraction: 1.630
Molar Refractivity: 62.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.35
ACD/LogD (pH 5.5): -0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.62
ACD/LogD (pH 7.4): -0.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.20
Polar Surface Area: 85 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 67.8±3.0 dyne/cm
Molar Volume: 174.1±3.0 cm3

Click to predict properties on the Chemicalize site


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