ChemSpider 2D Image | Methyl (7Z)-7-[(2E)-2-buten-1-ylidene]-1-oxo-1,7-dihydrocyclopenta[c]pyran-4-carboxylate | C14H12O4

Methyl (7Z)-7-[(2E)-2-buten-1-ylidene]-1-oxo-1,7-dihydrocyclopenta[c]pyran-4-carboxylate

  • Molecular FormulaC14H12O4
  • Average mass244.243 Da
  • Monoisotopic mass244.073563 Da
  • ChemSpider ID10718390

  • Double-bond stereo - Double-bond stereo

More details:

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

(7Z)-7-[(2E)-2-Butén-1-ylidène]-1-oxo-1,7-dihydrocyclopenta[c]pyrane-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
Cyclopenta[c]pyran-4-carboxylic acid, 7-[(2E)-2-buten-1-ylidene]-1,7-dihydro-1-oxo-, methyl ester, (7Z)- [ACD/Index Name]
Methyl (7Z)-7-[(2E)-2-buten-1-ylidene]-1-oxo-1,7-dihydrocyclopenta[c]pyran-4-carboxylate [ACD/IUPAC Name]
Methyl-(7Z)-7-[(2E)-2-buten-1-yliden]-1-oxo-1,7-dihydrocyclopenta[c]pyran-4-carboxylat [German] [ACD/IUPAC Name]
fulvoplumierin

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

Density: 1.3±0.1 g/cm3
Boiling Point: 455.4±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.5±3.0 kJ/mol
Flash Point: 239.3±20.2 °C
Index of Refraction: 1.584
Molar Refractivity: 65.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.07
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 32.14
ACD/KOC (pH 5.5): 417.22
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 32.14
ACD/KOC (pH 7.4): 417.22
Polar Surface Area: 53 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 45.6±5.0 dyne/cm
Molar Volume: 194.7±5.0 cm3

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