ChemSpider 2D Image | (3R)-7-[4-(4-Fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]-3,5-dihydroxyheptanoate | C24H25FNO4

(3R)-7-[4-(4-Fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]-3,5-dihydroxyheptanoate

  • Molecular FormulaC24H25FNO4
  • Average mass410.459 Da
  • Monoisotopic mass410.177307 Da
  • ChemSpider ID129181063

  • Charge - Charge

    defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(3R)-7-[4-(4-Fluorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]-3,5-dihydroxyheptanoate [ACD/IUPAC Name]
(3R)-7-[4-(4-Fluorophényl)-2-méthyl-1-phényl-1H-pyrrol-3-yl]-3,5-dihydroxyheptanoate [French] [ACD/IUPAC Name]
(3R)-7-[4-(4-Fluorphenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl]-3,5-dihydroxyheptanoat [German] [ACD/IUPAC Name]
1H-Pyrrole-3-heptanoic acid, 4-(4-fluorophenyl)-β,δ-dihydroxy-2-methyl-1-phenyl-, ion(1-), (βR)- [ACD/Index Name]

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

Density:
Boiling Point: 657.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.7±3.0 kJ/mol
Flash Point: 351.3±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 16.90
ACD/KOC (pH 5.5): 111.50
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.88
Polar Surface Area: 86 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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