ChemSpider 2D Image | Phenyl (2E)-3-(3-chloro-4-isobutoxy-5-methoxyphenyl)acrylate | C20H21ClO4

Phenyl (2E)-3-(3-chloro-4-isobutoxy-5-methoxyphenyl)acrylate

  • Molecular FormulaC20H21ClO4
  • Average mass360.831 Da
  • Monoisotopic mass360.112823 Da
  • ChemSpider ID22832358

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(3-Chloro-4-isobutoxy-5-méthoxyphényl)acrylate de phényle [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-[3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]-, phenyl ester, (2E)- [ACD/Index Name]
Phenyl (2E)-3-(3-chloro-4-isobutoxy-5-methoxyphenyl)acrylate [ACD/IUPAC Name]
Phenyl-(2E)-3-(3-chlor-4-isobutoxy-5-methoxyphenyl)acrylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 498.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 179.7±27.7 °C
Index of Refraction: 1.571
Molar Refractivity: 100.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.10
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 2350.18
ACD/KOC (pH 5.5): 9008.04
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2350.18
ACD/KOC (pH 7.4): 9008.04
Polar Surface Area: 45 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 305.8±3.0 cm3

Click to predict properties on the Chemicalize site


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