ChemSpider 2D Image | 4-[Hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylene]-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(2-phenylethyl)-2,3-pyrrolidinedione | C34H37NO6

4-[Hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylene]-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(2-phenylethyl)-2,3-pyrrolidinedione

  • Molecular FormulaC34H37NO6
  • Average mass555.661 Da
  • Monoisotopic mass555.262085 Da
  • ChemSpider ID2681585

More details:

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

2,3-Pyrrolidinedione, 4-[(2,3-dihydro-2-methyl-5-benzofuranyl)hydroxymethylene]-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(2-phenylethyl)- [ACD/Index Name]
4-[Hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylen]-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(2-phenylethyl)-2,3-pyrrolidindion [German] [ACD/IUPAC Name]
4-[Hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylene]-5-[3-methoxy-4-(pentyloxy)phenyl]-1-(2-phenylethyl)-2,3-pyrrolidinedione [ACD/IUPAC Name]
4-[Hydroxy(2-méthyl-2,3-dihydro-1-benzofuran-5-yl)méthylène]-5-[3-méthoxy-4-(pentyloxy)phényl]-1-(2-phényléthyl)-2,3-pyrrolidinedione [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 712.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.4±3.0 kJ/mol
Flash Point: 384.9±35.7 °C
Index of Refraction: 1.602
Molar Refractivity: 157.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.59
ACD/LogD (pH 5.5): 6.04
ACD/BCF (pH 5.5): 22960.18
ACD/KOC (pH 5.5): 45993.49
ACD/LogD (pH 7.4): 5.93
ACD/BCF (pH 7.4): 17642.98
ACD/KOC (pH 7.4): 35342.16
Polar Surface Area: 85 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 458.0±3.0 cm3

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