ChemSpider 2D Image | {3-[(4-Bromo-1H-pyrazol-1-yl)methyl]-1-azetidinyl}[1-(4-fluorophenyl)cyclopropyl]methanone | C17H17BrFN3O

{3-[(4-Bromo-1H-pyrazol-1-yl)methyl]-1-azetidinyl}[1-(4-fluorophenyl)cyclopropyl]methanone

  • Molecular FormulaC17H17BrFN3O
  • Average mass378.239 Da
  • Monoisotopic mass377.053894 Da
  • ChemSpider ID84399611

More details:

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

{3-[(4-Brom-1H-pyrazol-1-yl)methyl]-1-azetidinyl}[1-(4-fluorphenyl)cyclopropyl]methanon [German] [ACD/IUPAC Name]
{3-[(4-Bromo-1H-pyrazol-1-yl)methyl]-1-azetidinyl}[1-(4-fluorophenyl)cyclopropyl]methanone [ACD/IUPAC Name]
{3-[(4-Bromo-1H-pyrazol-1-yl)méthyl]-1-azétidinyl}[1-(4-fluorophényl)cyclopropyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [3-[(4-bromo-1H-pyrazol-1-yl)methyl]-1-azetidinyl][1-(4-fluorophenyl)cyclopropyl]- [ACD/Index Name]
2415491-87-9 [RN]
4-bromo-1-({1-[1-(4-fluorophenyl)cyclopropanecarbonyl]azetidin-3-yl}methyl)-1H-pyrazole

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

Density: 1.6±0.1 g/cm3
Boiling Point: 519.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.2±3.0 kJ/mol
Flash Point: 267.8±27.3 °C
Index of Refraction: 1.690
Molar Refractivity: 90.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 146.99
ACD/KOC (pH 5.5): 1238.69
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 146.99
ACD/KOC (pH 7.4): 1238.69
Polar Surface Area: 38 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 54.8±7.0 dyne/cm
Molar Volume: 236.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement