ChemSpider 2D Image | Methylenebis(2-oxo-2H-chromene-4,3-diyl) bis(2,2-dimethylpropanoate) | C29H28O8

Methylenebis(2-oxo-2H-chromene-4,3-diyl) bis(2,2-dimethylpropanoate)

  • Molecular FormulaC29H28O8
  • Average mass504.528 Da
  • Monoisotopic mass504.178406 Da
  • ChemSpider ID138981

More details:

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

Bis(2,2-diméthylpropanoate) de méthylènebis(2-oxo-2H-chromène-4,3-diyle) [French] [ACD/IUPAC Name]
Methylenbis(2-oxo-2H-chromen-4,3-diyl)-bis(2,2-dimethylpropanoat) [German] [ACD/IUPAC Name]
Methylenebis(2-oxo-2H-chromene-4,3-diyl) bis(2,2-dimethylpropanoate) [ACD/IUPAC Name]
Propanoic acid, 2,2-dimethyl-, methylenebis(2-oxo-2H-1-benzopyran-4,3-diyl) ester [ACD/Index Name]
4-[[3-(2,2-DIMETHYLPROPANOYLOXY)-2-OXO-CHROMEN-4-YL]METHYL]-2-OXO-CHR OMEN-3-YL] 2,2-DIMETHYLPROPANOATE
81456-57-7 [RN]
Propanoic acid, 2,2-dimethyl-, methylenebis(2-oxo-2H-1-benzopyran-3,4-diyl) ester

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

Density: 1.3±0.1 g/cm3
Boiling Point: 677.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.5±3.0 kJ/mol
Flash Point: 287.1±31.5 °C
Index of Refraction: 1.601
Molar Refractivity: 132.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.88
ACD/LogD (pH 5.5): 6.17
ACD/BCF (pH 5.5): 28729.26
ACD/KOC (pH 5.5): 54057.18
ACD/LogD (pH 7.4): 6.17
ACD/BCF (pH 7.4): 28729.26
ACD/KOC (pH 7.4): 54057.18
Polar Surface Area: 105 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 54.7±5.0 dyne/cm
Molar Volume: 386.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement