ChemSpider 2D Image | (3S,4R)-4-(3-Hydroxy-4-methoxyphenyl)-3-phenyl-1-(3,4,5-trimethoxyphenyl)-2-azetidinone | C25H25NO6

(3S,4R)-4-(3-Hydroxy-4-methoxyphenyl)-3-phenyl-1-(3,4,5-trimethoxyphenyl)-2-azetidinone

  • Molecular FormulaC25H25NO6
  • Average mass435.469 Da
  • Monoisotopic mass435.168182 Da
  • ChemSpider ID29420144

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,4R)-4-(3-Hydroxy-4-methoxyphenyl)-3-phenyl-1-(3,4,5-trimethoxyphenyl)-2-azetidinon [German] [ACD/IUPAC Name]
(3S,4R)-4-(3-Hydroxy-4-methoxyphenyl)-3-phenyl-1-(3,4,5-trimethoxyphenyl)-2-azetidinone [ACD/IUPAC Name]
(3S,4R)-4-(3-Hydroxy-4-méthoxyphényl)-3-phényl-1-(3,4,5-triméthoxyphényl)-2-azétidinone [French] [ACD/IUPAC Name]
2-Azetidinone, 4-(3-hydroxy-4-methoxyphenyl)-3-phenyl-1-(3,4,5-trimethoxyphenyl)-, (3S,4R)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 677.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.1±3.0 kJ/mol
Flash Point: 363.6±31.5 °C
Index of Refraction: 1.608
Molar Refractivity: 119.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 3.50
ACD/BCF (pH 5.5): 268.99
ACD/KOC (pH 5.5): 1909.00
ACD/LogD (pH 7.4): 3.50
ACD/BCF (pH 7.4): 267.50
ACD/KOC (pH 7.4): 1898.39
Polar Surface Area: 77 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 345.5±3.0 cm3

Click to predict properties on the Chemicalize site


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