ChemSpider 2D Image | Methyl N-[(5,6-dimethyl-1-benzofuran-3-yl)acetyl]leucinate | C19H25NO4

Methyl N-[(5,6-dimethyl-1-benzofuran-3-yl)acetyl]leucinate

  • Molecular FormulaC19H25NO4
  • Average mass331.406 Da
  • Monoisotopic mass331.178345 Da
  • ChemSpider ID22818658

More details:






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

Leucine, N-[2-(5,6-dimethyl-3-benzofuranyl)acetyl]-, methyl ester [ACD/Index Name]
Methyl N-[(5,6-dimethyl-1-benzofuran-3-yl)acetyl]leucinate [ACD/IUPAC Name]
Methyl-N-[(5,6-dimethyl-1-benzofuran-3-yl)acetyl]leucinat [German] [ACD/IUPAC Name]
N-[2-(5,6-Diméthyl-1-benzofuran-3-yl)acétyl]leucinate de méthyle [French] [ACD/IUPAC Name]
C19H25NO4
methyl 2-(2-(5,6-dimethylbenzofuran-3-yl)acetamido)-4-methylpentanoate

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 495.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.4±28.7 °C
Index of Refraction: 1.540
Molar Refractivity: 93.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 607.44
ACD/KOC (pH 5.5): 3420.07
ACD/LogD (pH 7.4): 3.96
ACD/BCF (pH 7.4): 607.44
ACD/KOC (pH 7.4): 3420.07
Polar Surface Area: 69 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 297.4±3.0 cm3

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