ChemSpider 2D Image | {2-[4-Hydroxy-3-(methoxycarbonyl)phenyl]-4-oxo-4H-furo[3,2-c]chromen-3-yl}acetic acid | C21H14O8

{2-[4-Hydroxy-3-(methoxycarbonyl)phenyl]-4-oxo-4H-furo[3,2-c]chromen-3-yl}acetic acid

  • Molecular FormulaC21H14O8
  • Average mass394.331 Da
  • Monoisotopic mass394.068878 Da
  • ChemSpider ID58173548

More details:

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

{2-[4-Hydroxy-3-(methoxycarbonyl)phenyl]-4-oxo-4H-furo[3,2-c]chromen-3-yl}acetic acid [ACD/IUPAC Name]
{2-[4-Hydroxy-3-(methoxycarbonyl)phenyl]-4-oxo-4H-furo[3,2-c]chromen-3-yl}essigsäure [German] [ACD/IUPAC Name]
4H-Furo[3,2-c][1]benzopyran-3-acetic acid, 2-[4-hydroxy-3-(methoxycarbonyl)phenyl]-4-oxo- [ACD/Index Name]
Acide {2-[4-hydroxy-3-(méthoxycarbonyl)phényl]-4-oxo-4H-furo[3,2-c]chromén-3-yl}acétique [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 661.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.2±3.0 kJ/mol
Flash Point: 353.6±31.5 °C
Index of Refraction: 1.653
Molar Refractivity: 97.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 12.65
ACD/KOC (pH 5.5): 63.01
ACD/LogD (pH 7.4): 0.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.59
Polar Surface Area: 123 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 66.1±3.0 dyne/cm
Molar Volume: 265.5±3.0 cm3

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