ChemSpider 2D Image | 1-Decyl-5-[4-(hexyloxy)-3-methoxyphenyl]-3-hydroxy-4-(5,6,7,8-tetrahydro-2-naphthalenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one | C38H53NO5

1-Decyl-5-[4-(hexyloxy)-3-methoxyphenyl]-3-hydroxy-4-(5,6,7,8-tetrahydro-2-naphthalenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC38H53NO5
  • Average mass603.831 Da
  • Monoisotopic mass603.392395 Da
  • ChemSpider ID117895253

More details:

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

1-Décyl-5-[4-(hexyloxy)-3-méthoxyphényl]-3-hydroxy-4-(5,6,7,8-tétrahydro-2-naphtalénylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
1-Decyl-5-[4-(hexyloxy)-3-methoxyphenyl]-3-hydroxy-4-(5,6,7,8-tetrahydro-2-naphthalenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-Decyl-5-[4-(hexyloxy)-3-methoxyphenyl]-3-hydroxy-4-(5,6,7,8-tetrahydro-2-naphthalinylcarbonyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1-decyl-5-[4-(hexyloxy)-3-methoxyphenyl]-1,5-dihydro-3-hydroxy-4-[(5,6,7,8-tetrahydro-2-naphthalenyl)carbonyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 737.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.0±3.0 kJ/mol
Flash Point: 400.0±32.9 °C
Index of Refraction: 1.556
Molar Refractivity: 177.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 2
ACD/LogP: 11.57
ACD/LogD (pH 5.5): 9.66
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1440205.25
ACD/LogD (pH 7.4): 7.90
ACD/BCF (pH 7.4): 125799.38
ACD/KOC (pH 7.4): 24844.04
Polar Surface Area: 76 Å2
Polarizability: 70.2±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 550.7±3.0 cm3

Click to predict properties on the Chemicalize site


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