ChemSpider 2D Image | N-(4-Fluorobenzyl)-N-{[2-(2-fluorobenzyl)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]acetyl}glycine | C27H25F2NO4

N-(4-Fluorobenzyl)-N-{[2-(2-fluorobenzyl)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]acetyl}glycine

  • Molecular FormulaC27H25F2NO4
  • Average mass465.488 Da
  • Monoisotopic mass465.175171 Da
  • ChemSpider ID68644013

More details:

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

Glycine, N-[(4-fluorophenyl)methyl]-N-[2-[2-[(2-fluorophenyl)methyl]-2,3-dihydro-2-methyl-5-benzofuranyl]acetyl]- [ACD/Index Name]
N-(4-Fluorbenzyl)-N-{[2-(2-fluorbenzyl)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]acetyl}glycin [German] [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-N-{[2-(2-fluorobenzyl)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]acetyl}glycine [ACD/IUPAC Name]
N-(4-Fluorobenzyl)-N-{2-[2-(2-fluorobenzyl)-2-méthyl-2,3-dihydro-1-benzofuran-5-yl]acétyl}glycine [French] [ACD/IUPAC Name]
{N-[(4-FLUOROPHENYL)METHYL]-2-{2-[(2-FLUOROPHENYL)METHYL]-2-METHYL-3H-1-BENZOFURAN-5-YL}ACETAMIDO}ACETIC ACID

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

Density: 1.3±0.1 g/cm3
Boiling Point: 646.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.2±3.0 kJ/mol
Flash Point: 344.6±31.5 °C
Index of Refraction: 1.602
Molar Refractivity: 122.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.31
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 18.51
ACD/KOC (pH 5.5): 60.01
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.17
Polar Surface Area: 67 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 54.1±3.0 dyne/cm
Molar Volume: 356.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement