ChemSpider 2D Image | 5-[1-(2-hydroxyethyl)-3-pyridin-4-yl-4-pyrazolyl]-2,3-dihydroinden-1-one oxime | C19H18N4O2

5-[1-(2-hydroxyethyl)-3-pyridin-4-yl-4-pyrazolyl]-2,3-dihydroinden-1-one oxime

  • Molecular FormulaC19H18N4O2
  • Average mass334.372 Da
  • Monoisotopic mass334.142975 Da
  • ChemSpider ID28654177

More details:

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

1H-Inden-1-one, 2,3-dihydro-5-[1-(2-hydroxyethyl)-3-(4-pyridinyl)-1H-pyrazol-4-yl]-, oxime [ACD/Index Name]
2-{4-[1-(Hydroxyimino)-2,3-dihydro-1H-inden-5-yl]-3-(4-pyridinyl)-1H-pyrazol-1-yl}ethanol [German] [ACD/IUPAC Name]
2-{4-[1-(Hydroxyimino)-2,3-dihydro-1H-inden-5-yl]-3-(4-pyridinyl)-1H-pyrazol-1-yl}ethanol [ACD/IUPAC Name]
2-{4-[1-(Hydroxyimino)-2,3-dihydro-1H-indén-5-yl]-3-(4-pyridinyl)-1H-pyrazol-1-yl}éthanol [French] [ACD/IUPAC Name]
5-[1-(2-hydroxyethyl)-3-pyridin-4-yl-4-pyrazolyl]-2,3-dihydroinden-1-one oxime
905281-76-7 [RN]
(E)-5-(1-(2-hydroxyethyl)-3-(pyridin-4-yl)-1H-pyrazol-4-yl)-2,3-dihydroinden-1-one oxime
GDC0879
GDC-0879

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

Density: 1.4±0.1 g/cm3
Boiling Point: 562.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 294.0±30.1 °C
Index of Refraction: 1.705
Molar Refractivity: 94.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.12
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 17.30
ACD/KOC (pH 5.5): 267.71
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 17.32
ACD/KOC (pH 7.4): 268.00
Polar Surface Area: 84 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 58.2±7.0 dyne/cm
Molar Volume: 243.8±7.0 cm3

Click to predict properties on the Chemicalize site


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