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Search term: DHVPJCVPOZYDTH-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-[(3-Chloro-2-methylphenoxy)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one | C19H15ClN4O2

5-[(3-Chloro-2-methylphenoxy)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one

  • Molecular FormulaC19H15ClN4O2
  • Average mass366.801 Da
  • Monoisotopic mass366.088348 Da
  • ChemSpider ID115037027

More details:

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

[1,2,4]Triazolo[1,5-a]pyrimidin-7(1H)-one, 5-[(3-chloro-2-methylphenoxy)methyl]-2-phenyl- [ACD/Index Name]
5-[(3-Chlor-2-methylphenoxy)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-on [German] [ACD/IUPAC Name]
5-[(3-Chloro-2-methylphenoxy)methyl]-2-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one [ACD/IUPAC Name]
5-[(3-Chloro-2-méthylphénoxy)méthyl]-2-phényl[1,2,4]triazolo[1,5-a]pyrimidin-7(1H)-one [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 514.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.6±3.0 kJ/mol
Flash Point: 265.1±32.9 °C
Index of Refraction: 1.688
Molar Refractivity: 99.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): 2.75
ACD/BCF (pH 5.5): 61.54
ACD/KOC (pH 5.5): 550.04
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 118.10
ACD/KOC (pH 7.4): 1055.48
Polar Surface Area: 66 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 53.9±7.0 dyne/cm
Molar Volume: 261.5±7.0 cm3

Click to predict properties on the Chemicalize site


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