ChemSpider 2D Image | (2E)-1-(5-Chloro-2,4-dimethoxyphenyl)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-propen-1-one | C18H16Cl2O5

(2E)-1-(5-Chloro-2,4-dimethoxyphenyl)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-propen-1-one

  • Molecular FormulaC18H16Cl2O5
  • Average mass383.223 Da
  • Monoisotopic mass382.037476 Da
  • ChemSpider ID22831351

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-(5-Chlor-2,4-dimethoxyphenyl)-3-(3-chlor-4-hydroxy-5-methoxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-(5-Chloro-2,4-dimethoxyphenyl)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-(5-Chloro-2,4-diméthoxyphényl)-3-(3-chloro-4-hydroxy-5-méthoxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-(5-chloro-2,4-dimethoxyphenyl)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-, (2E)- [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: 561.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 293.1±30.1 °C
Index of Refraction: 1.612
Molar Refractivity: 98.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.65
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1343.14
ACD/KOC (pH 5.5): 6031.77
ACD/LogD (pH 7.4): 4.35
ACD/BCF (pH 7.4): 1151.30
ACD/KOC (pH 7.4): 5170.25
Polar Surface Area: 65 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 284.2±3.0 cm3

Click to predict properties on the Chemicalize site


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