ChemSpider 2D Image | 3-[9-(Carboxymethyl)-8-(4-methoxyphenyl)-4-methyl-2-oxo-2H-furo[2,3-h]chromen-6-yl]propanoic acid | C24H20O8

3-[9-(Carboxymethyl)-8-(4-methoxyphenyl)-4-methyl-2-oxo-2H-furo[2,3-h]chromen-6-yl]propanoic acid

  • Molecular FormulaC24H20O8
  • Average mass436.411 Da
  • Monoisotopic mass436.115814 Da
  • ChemSpider ID81417884

More details:

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

2H-Furo[2,3-h]-1-benzopyran-6-propanoic acid, 9-(carboxymethyl)-8-(4-methoxyphenyl)-4-methyl-2-oxo- [ACD/Index Name]
3-[9-(Carboxymethyl)-8-(4-methoxyphenyl)-4-methyl-2-oxo-2H-furo[2,3-h]chromen-6-yl]propanoic acid [ACD/IUPAC Name]
3-[9-(Carboxymethyl)-8-(4-methoxyphenyl)-4-methyl-2-oxo-2H-furo[2,3-h]chromen-6-yl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[9-(carboxyméthyl)-8-(4-méthoxyphényl)-4-méthyl-2-oxo-2H-furo[2,3-h]chromén-6-yl]propanoïque [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 731.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 396.3±32.9 °C
Index of Refraction: 1.641
Molar Refractivity: 112.7±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 0.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.36
ACD/LogD (pH 7.4): -1.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 123 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 61.0±3.0 dyne/cm
Molar Volume: 312.7±3.0 cm3

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