ChemSpider 2D Image | 4-[4-(Benzyloxy)phenyl]-1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxopropyl]-2-azetidinone | C31H25F2NO3

4-[4-(Benzyloxy)phenyl]-1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxopropyl]-2-azetidinone

  • Molecular FormulaC31H25F2NO3
  • Average mass497.532 Da
  • Monoisotopic mass497.180237 Da
  • ChemSpider ID26404045

More details:

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

2-Azetidinone, 1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxopropyl]-4-[4-(phenylmethoxy)phenyl]- [ACD/Index Name]
4-[4-(Benzyloxy)phenyl]-1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxopropyl]-2-azetidinone [ACD/IUPAC Name]
4-[4-(Benzyloxy)phényl]-1-(4-fluorophényl)-3-[3-(4-fluorophényl)-3-oxopropyl]-2-azétidinone [French] [ACD/IUPAC Name]
4-[4-(Benzyloxy)phenyl]-1-(4-fluorphenyl)-3-[3-(4-fluorphenyl)-3-oxopropyl]-2-azetidinon [German] [ACD/IUPAC Name]
(3R,4S)-4-(4-(benzyloxy)phenyl)-1-(4-fluorophenyl)-3-(3-(4-fluorophenyl)-3-oxopropyl)azetidin-2-one
1198089-61-0 [RN]
190595-65-4 [RN]
2-Azetidinone,1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-oxopropyl]-4-[4-(phenylmethoxy)phenyl]-
4-[4-(BENZYLOXY)PHENYL]-1-(4-FLUOROPHENYL)-3-[3-(4-FLUOROPHENYL)-3-OXOPROPYL]AZETIDIN-2-ONE
MFCD13185976 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 706.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.4±3.0 kJ/mol
Flash Point: 381.3±32.9 °C
Index of Refraction: 1.610
Molar Refractivity: 136.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.10
ACD/LogD (pH 5.5): 5.87
ACD/BCF (pH 5.5): 16936.37
ACD/KOC (pH 5.5): 37031.93
ACD/LogD (pH 7.4): 5.87
ACD/BCF (pH 7.4): 16936.39
ACD/KOC (pH 7.4): 37031.97
Polar Surface Area: 47 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 393.5±3.0 cm3

Click to predict properties on the Chemicalize site


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