ChemSpider 2D Image | 1-{4-[(9-Chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methoxy]-3-methoxyphenyl}ethanone | C19H19ClO5

1-{4-[(9-Chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methoxy]-3-methoxyphenyl}ethanone

  • Molecular FormulaC19H19ClO5
  • Average mass362.804 Da
  • Monoisotopic mass362.092102 Da
  • ChemSpider ID22557915

More details:

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

1-{4-[(9-Chlor-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methoxy]-3-methoxyphenyl}ethanon [German] [ACD/IUPAC Name]
1-{4-[(9-Chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methoxy]-3-methoxyphenyl}ethanone [ACD/IUPAC Name]
1-{4-[(9-Chloro-3,4-dihydro-2H-1,5-benzodioxépin-7-yl)méthoxy]-3-méthoxyphényl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-[(9-chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methoxy]-3-methoxyphenyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 506.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 189.9±29.1 °C
Index of Refraction: 1.569
Molar Refractivity: 94.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.31
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 528.08
ACD/KOC (pH 5.5): 3093.94
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 528.08
ACD/KOC (pH 7.4): 3093.94
Polar Surface Area: 54 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 288.3±3.0 cm3

Click to predict properties on the Chemicalize site


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