ChemSpider 2D Image | 5,7-Dimethoxy-8-[3-(3-methyl-1-piperidinyl)-1-(3,4,5-trimethoxyphenyl)propyl]-4-pentyl-2H-chromen-2-one | C34H47NO7

5,7-Dimethoxy-8-[3-(3-methyl-1-piperidinyl)-1-(3,4,5-trimethoxyphenyl)propyl]-4-pentyl-2H-chromen-2-one

  • Molecular FormulaC34H47NO7
  • Average mass581.740 Da
  • Monoisotopic mass581.335266 Da
  • ChemSpider ID20577552

More details:

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

2H-1-Benzopyran-2-one, 5,7-dimethoxy-8-[3-(3-methyl-1-piperidinyl)-1-(3,4,5-trimethoxyphenyl)propyl]-4-pentyl- [ACD/Index Name]
5,7-Dimethoxy-8-[3-(3-methyl-1-piperidinyl)-1-(3,4,5-trimethoxyphenyl)propyl]-4-pentyl-2H-chromen-2-on [German] [ACD/IUPAC Name]
5,7-Dimethoxy-8-[3-(3-methyl-1-piperidinyl)-1-(3,4,5-trimethoxyphenyl)propyl]-4-pentyl-2H-chromen-2-one [ACD/IUPAC Name]
5,7-Diméthoxy-8-[3-(3-méthyl-1-pipéridinyl)-1-(3,4,5-triméthoxyphényl)propyl]-4-pentyl-2H-chromén-2-one [French] [ACD/IUPAC 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: 705.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.3±3.0 kJ/mol
Flash Point: 380.6±32.9 °C
Index of Refraction: 1.534
Molar Refractivity: 164.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 7.32
ACD/LogD (pH 5.5): 3.64
ACD/BCF (pH 5.5): 65.42
ACD/KOC (pH 5.5): 96.19
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 924.04
ACD/KOC (pH 7.4): 1358.81
Polar Surface Area: 76 Å2
Polarizability: 65.1±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 528.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement