ChemSpider 2D Image | 4-Iodo-1-(4-methoxybenzyl)-1H-pyrazole | C11H11IN2O

4-Iodo-1-(4-methoxybenzyl)-1H-pyrazole

  • Molecular FormulaC11H11IN2O
  • Average mass314.122 Da
  • Monoisotopic mass313.991608 Da
  • ChemSpider ID28542418

More details:

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

1H-Pyrazole, 4-iodo-1-[(4-methoxyphenyl)methyl]- [ACD/Index Name]
4-Iod-1-(4-methoxybenzyl)-1H-pyrazol [German] [ACD/IUPAC Name]
4-Iodo-1-(4-methoxybenzyl)-1H-pyrazole [ACD/IUPAC Name]
4-Iodo-1-(4-méthoxybenzyl)-1H-pyrazole [French] [ACD/IUPAC Name]
4-IODO-1-[(4-METHOXYPHENYL)METHYL]-1H-PYRAZOLE
4-iodo-1-[(4-methoxyphenyl)methyl]pyrazole
905751-58-8 [RN]
MFCD20568993 [MDL number]
4-Iodo-1-(4-methoxy-benzyl)-1H-pyrazole
4-iodo-1-[(4-methoxyphenyl)methyl]-1h-pyrazole(wx638059)
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point: 405.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.2±3.0 kJ/mol
Flash Point: 199.1±24.6 °C
Index of Refraction: 1.641
Molar Refractivity: 69.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 120.63
ACD/KOC (pH 5.5): 1075.25
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 120.63
ACD/KOC (pH 7.4): 1075.25
Polar Surface Area: 27 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 45.7±7.0 dyne/cm
Molar Volume: 191.4±7.0 cm3

Click to predict properties on the Chemicalize site


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