ChemSpider 2D Image | 6,7,8-Trimethoxy-4-methyl-2(1H)-quinolinone | C13H15NO4

6,7,8-Trimethoxy-4-methyl-2(1H)-quinolinone

  • Molecular FormulaC13H15NO4
  • Average mass249.262 Da
  • Monoisotopic mass249.100113 Da
  • ChemSpider ID24689037

More details:

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

2(1H)-Quinolinone, 6,7,8-trimethoxy-4-methyl- [ACD/Index Name]
6,7,8-Trimethoxy-4-methyl-2(1H)-chinolinon [German] [ACD/IUPAC Name]
6,7,8-Triméthoxy-4-méthyl-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
6,7,8-Trimethoxy-4-methyl-2(1H)-quinolinone [ACD/IUPAC Name]
6,7,8-Trimethoxy-4-Methylquinolin-2(1h)-One
casimiroin analogue, 1m
HGZ
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL454226/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 429.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.5±3.0 kJ/mol
Flash Point: 213.5±28.7 °C
Index of Refraction: 1.537
Molar Refractivity: 66.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.80
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 11.27
ACD/KOC (pH 5.5): 197.02
ACD/LogD (pH 7.4): 1.68
ACD/BCF (pH 7.4): 11.22
ACD/KOC (pH 7.4): 196.25
Polar Surface Area: 57 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 37.8±3.0 dyne/cm
Molar Volume: 212.1±3.0 cm3

Click to predict properties on the Chemicalize site


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