ChemSpider 2D Image | benzaldehyde, 4-hydroxy-3-methoxy-, 2-(5H-pyrazolo[3,4-d]pyrimidin-4-yl)hydrazone | C13H12N6O2

benzaldehyde, 4-hydroxy-3-methoxy-, 2-(5H-pyrazolo[3,4-d]pyrimidin-4-yl)hydrazone

  • Molecular FormulaC13H12N6O2
  • Average mass284.273 Da
  • Monoisotopic mass284.102173 Da
  • ChemSpider ID23158630

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Méthoxy-4-[(E)-(1H-pyrazolo[3,4-d]pyrimidin-4-ylhydrazono)méthyl]phénol [French] [ACD/IUPAC Name]
2-methoxy-4-{(E)-[2-(5H-pyrazolo[3,4-d]pyrimidin-4-yl)hydrazinylidene]methyl}phenol
4-{(E)-[(2E)-1,5-Dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-ylidenehydrazono]methyl}-2-methoxyphenol [ACD/IUPAC Name]
4-{(E)-[(2E)-1,5-Dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-ylidenhydrazono]methyl}-2-methoxyphenol [German] [ACD/IUPAC Name]
Benzaldehyde, 4-hydroxy-3-methoxy-, 2-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)hydrazone [ACD/Index Name]
benzaldehyde, 4-hydroxy-3-methoxy-, 2-(5H-pyrazolo[3,4-d]pyrimidin-4-yl)hydrazone
(E)-2-Methoxy-4-[(1H-pyrazolo[3,4-d]pyrimidin-4-yl)-hydrazonomethyl]-phenol
GW578748X

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

Density: 1.5±0.1 g/cm3
Boiling Point: 569.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 298.0±30.1 °C
Index of Refraction: 1.734
Molar Refractivity: 75.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 14.26
ACD/KOC (pH 5.5): 227.86
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 12.56
ACD/KOC (pH 7.4): 200.63
Polar Surface Area: 108 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 62.7±7.0 dyne/cm
Molar Volume: 187.6±7.0 cm3

Click to predict properties on the Chemicalize site


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