ChemSpider 2D Image | 2-{4-[(S)-(4-Chlorophenyl)(hydroxy)methyl]phenoxy}-2-methylpropanoic acid | C17H17ClO4

2-{4-[(S)-(4-Chlorophenyl)(hydroxy)methyl]phenoxy}-2-methylpropanoic acid

  • Molecular FormulaC17H17ClO4
  • Average mass320.767 Da
  • Monoisotopic mass320.081543 Da
  • ChemSpider ID34996114

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-{4-[(S)-(4-Chlorophenyl)(hydroxy)methyl]phenoxy}-2-methylpropanoic acid [ACD/IUPAC Name]
2-{4-[(S)-(4-Chlorphenyl)(hydroxy)methyl]phenoxy}-2-methylpropansäure [German] [ACD/IUPAC Name]
Acide 2-{4-[(S)-(4-chlorophényl)(hydroxy)méthyl]phénoxy}-2-méthylpropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 2-[4-[(S)-(4-chlorophenyl)hydroxymethyl]phenoxy]-2-methyl- [ACD/Index Name]
54419-31-7 [RN]
Fenirofibrate [INN]
UNII-2VG7825GP4

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

Density: 1.3±0.1 g/cm3
Boiling Point: 500.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 256.4±30.1 °C
Index of Refraction: 1.596
Molar Refractivity: 84.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.24
ACD/LogD (pH 7.4): -0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 67 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 247.2±3.0 cm3

Click to predict properties on the Chemicalize site


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