ChemSpider 2D Image | (2-Formyl-3,4-dimethoxyphenyl)(4-hydroxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl acetate | C23H25NO8

(2-Formyl-3,4-dimethoxyphenyl)(4-hydroxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl acetate

  • Molecular FormulaC23H25NO8
  • Average mass443.447 Da
  • Monoisotopic mass443.158020 Da
  • ChemSpider ID115042154

More details:

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

(2-Formyl-3,4-dimethoxyphenyl)(4-hydroxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isochinolin-5-yl)methyl-acetat [German] [ACD/IUPAC Name]
(2-Formyl-3,4-dimethoxyphenyl)(4-hydroxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)methyl acetate [ACD/IUPAC Name]
Acétate de (2-formyl-3,4-diméthoxyphényl)(4-hydroxy-6-méthyl-5,6,7,8-tétrahydro[1,3]dioxolo[4,5-g]isoquinoléin-5-yl)méthyle [French] [ACD/IUPAC Name]
Benzaldehyde, 6-[(acetyloxy)(5,6,7,8-tetrahydro-4-hydroxy-6-methyl-1,3-dioxolo[4,5-g]isoquinolin-5-yl)methyl]-2,3-dimethoxy- [ACD/Index Name]
3-O-acetyl-4'-O-demethylpapaveroxine
4'-O-desmethyl-3-O-acetylpapaveroxine
C21590

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

Density: 1.3±0.1 g/cm3
Boiling Point: 556.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.9±3.0 kJ/mol
Flash Point: 290.1±30.1 °C
Index of Refraction: 1.609
Molar Refractivity: 115.1±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 1.20
ACD/BCF (pH 5.5): 2.76
ACD/KOC (pH 5.5): 37.55
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 23.91
ACD/KOC (pH 7.4): 325.07
Polar Surface Area: 104 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 54.3±3.0 dyne/cm
Molar Volume: 332.1±3.0 cm3

Click to predict properties on the Chemicalize site


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