ChemSpider 2D Image | N-{1-[2-(Benzyloxy)-5-chlorobenzyl]-5-methyl-1H-pyrazol-3-yl}-2,2-difluoro-2-phenylacetamide | C26H22ClF2N3O2

N-{1-[2-(Benzyloxy)-5-chlorobenzyl]-5-methyl-1H-pyrazol-3-yl}-2,2-difluoro-2-phenylacetamide

  • Molecular FormulaC26H22ClF2N3O2
  • Average mass481.922 Da
  • Monoisotopic mass481.136871 Da
  • ChemSpider ID23315256

More details:

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

Benzeneacetamide, N-[1-[[5-chloro-2-(phenylmethoxy)phenyl]methyl]-5-methyl-1H-pyrazol-3-yl]-α,α-difluoro- [ACD/Index Name]
N-{1-[2-(Benzyloxy)-5-chlorbenzyl]-5-methyl-1H-pyrazol-3-yl}-2,2-difluor-2-phenylacetamid [German] [ACD/IUPAC Name]
N-{1-[2-(Benzyloxy)-5-chlorobenzyl]-5-methyl-1H-pyrazol-3-yl}-2,2-difluoro-2-phenylacetamide [ACD/IUPAC Name]
N-{1-[2-(Benzyloxy)-5-chlorobenzyl]-5-méthyl-1H-pyrazol-3-yl}-2,2-difluoro-2-phénylacétamide [French] [ACD/IUPAC Name]
N-(1-(2-(benzyloxy)-5-chlorobenzyl)-5-methyl-1H-pyrazol-3-yl)-2,2-difluoro-2-phenylacetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 655.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 349.9±31.5 °C
Index of Refraction: 1.595
Molar Refractivity: 129.2±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.70
ACD/LogD (pH 5.5): 6.16
ACD/BCF (pH 5.5): 28306.00
ACD/KOC (pH 5.5): 53485.34
ACD/LogD (pH 7.4): 6.16
ACD/BCF (pH 7.4): 28302.21
ACD/KOC (pH 7.4): 53478.18
Polar Surface Area: 56 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 43.1±7.0 dyne/cm
Molar Volume: 380.2±7.0 cm3

Click to predict properties on the Chemicalize site


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