ChemSpider 2D Image | (2E)-1-[3-(2-Chloroethyl)-4-hydroxyphenyl]-3-(4-ethoxy-3-methoxyphenyl)-2-propen-1-one | C20H21ClO4

(2E)-1-[3-(2-Chloroethyl)-4-hydroxyphenyl]-3-(4-ethoxy-3-methoxyphenyl)-2-propen-1-one

  • Molecular FormulaC20H21ClO4
  • Average mass360.831 Da
  • Monoisotopic mass360.112823 Da
  • ChemSpider ID22857190

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1-[3-(2-Chlorethyl)-4-hydroxyphenyl]-3-(4-ethoxy-3-methoxyphenyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-[3-(2-Chloroethyl)-4-hydroxyphenyl]-3-(4-ethoxy-3-methoxyphenyl)-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-[3-(2-Chloroéthyl)-4-hydroxyphényl]-3-(4-éthoxy-3-méthoxyphényl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-[3-(2-chloroethyl)-4-hydroxyphenyl]-3-(4-ethoxy-3-methoxyphenyl)-, (2E)- [ACD/Index Name]
(2E)-1-[3-(2-CHLOROETHYL)-4-HYDROXYPHENYL]-3-(4-ETHOXY-3-METHOXYPHENYL)PROP-2-EN-1-ONE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 560.6±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: 292.9±30.1 °C
Index of Refraction: 1.598
Molar Refractivity: 101.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 4.22
ACD/BCF (pH 5.5): 940.80
ACD/KOC (pH 5.5): 4671.12
ACD/LogD (pH 7.4): 4.07
ACD/BCF (pH 7.4): 679.13
ACD/KOC (pH 7.4): 3371.93
Polar Surface Area: 56 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 297.0±3.0 cm3

Click to predict properties on the Chemicalize site


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