ChemSpider 2D Image | (3Z)-3-[(2E)-1-Hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propen-1-ylidene]-6-methyl-2H-pyran-2,4(3H)-dione | C17H16O7

(3Z)-3-[(2E)-1-Hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propen-1-ylidene]-6-methyl-2H-pyran-2,4(3H)-dione

  • Molecular FormulaC17H16O7
  • Average mass332.305 Da
  • Monoisotopic mass332.089600 Da
  • ChemSpider ID57447473

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-3-[(2E)-1-Hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propen-1-yliden]-6-methyl-2H-pyran-2,4(3H)-dion [German] [ACD/IUPAC Name]
(3Z)-3-[(2E)-1-Hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propen-1-ylidene]-6-methyl-2H-pyran-2,4(3H)-dione [ACD/IUPAC Name]
(3Z)-3-[(2E)-1-Hydroxy-3-(4-hydroxy-3,5-diméthoxyphényl)-2-propén-1-ylidène]-6-méthyl-2H-pyrane-2,4(3H)-dione [French] [ACD/IUPAC Name]
2H-Pyran-2,4(3H)-dione, 3-[(2E)-1-hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propen-1-ylidene]-6-methyl-, (3Z)- [ACD/Index Name]
(3Z)-3-[(2E)-1-Hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-en-1-ylidene]-6-methyl-2H-pyran-2,4(3H)-dione
3-[1-HYDROXY-3-(4-HYDROXY-3,5-DIMETHOXYPHENYL)PROP-2-EN-1-YLIDENE]-6-METHYLPYRAN-2,4-DIONE
331852-66-5 [RN]
Suptopin-2

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

Density: 1.4±0.1 g/cm3
Boiling Point: 564.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.2±3.0 kJ/mol
Flash Point: 207.7±23.6 °C
Index of Refraction: 1.633
Molar Refractivity: 85.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 0.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.02
ACD/LogD (pH 7.4): -1.76
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 34.0±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 239.9±3.0 cm3

Click to predict properties on the Chemicalize site


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