Found 5 results

Search term: MF = 'C_{37}H_{44}BrNO_{6}'
ChemSpider 2D Image | 5-(3-Bromo-4-butoxy-5-methoxyphenyl)-4-(4-butylbenzoyl)-3-hydroxy-1-{2-[(2-methyl-2-propanyl)oxy]benzyl}-1,5-dihydro-2H-pyrrol-2-one | C37H44BrNO6

5-(3-Bromo-4-butoxy-5-methoxyphenyl)-4-(4-butylbenzoyl)-3-hydroxy-1-{2-[(2-methyl-2-propanyl)oxy]benzyl}-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC37H44BrNO6
  • Average mass678.652 Da
  • Monoisotopic mass677.235168 Da
  • ChemSpider ID118227704

More details:

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

2H-Pyrrol-2-one, 5-(3-bromo-4-butoxy-5-methoxyphenyl)-4-(4-butylbenzoyl)-1-[[2-(1,1-dimethylethoxy)phenyl]methyl]-1,5-dihydro-3-hydroxy- [ACD/Index Name]
5-(3-Brom-4-butoxy-5-methoxyphenyl)-4-(4-butylbenzoyl)-3-hydroxy-1-{2-[(2-methyl-2-propanyl)oxy]benzyl}-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-(3-Bromo-4-butoxy-5-methoxyphenyl)-4-(4-butylbenzoyl)-3-hydroxy-1-{2-[(2-methyl-2-propanyl)oxy]benzyl}-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(3-Bromo-4-butoxy-5-méthoxyphényl)-4-(4-butylbenzoyl)-3-hydroxy-1-{2-[(2-méthyl-2-propanyl)oxy]benzyl}-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 750.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.7±3.0 kJ/mol
Flash Point: 407.5±32.9 °C
Index of Refraction: 1.591
Molar Refractivity: 180.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 9.81
ACD/LogD (pH 5.5): 7.05
ACD/BCF (pH 5.5): 75543.93
ACD/KOC (pH 5.5): 54677.75
ACD/LogD (pH 7.4): 5.29
ACD/BCF (pH 7.4): 1303.16
ACD/KOC (pH 7.4): 943.21
Polar Surface Area: 85 Å2
Polarizability: 71.7±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 535.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement