ChemSpider 2D Image | Ethyl (2E)-3-hydroxy-2-{[(E)-2-(4-methoxyphenyl)vinyl]carbamoyl}-2-butenoate | C16H19NO5

Ethyl (2E)-3-hydroxy-2-{[(E)-2-(4-methoxyphenyl)vinyl]carbamoyl}-2-butenoate

  • Molecular FormulaC16H19NO5
  • Average mass305.326 Da
  • Monoisotopic mass305.126312 Da
  • ChemSpider ID30657563

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-Hydroxy-2-{[(E)-2-(4-méthoxyphényl)vinyl]carbamoyl}-2-buténoate d'éthyle [French] [ACD/IUPAC Name]
2-Butenoic acid, 3-hydroxy-2-[[[(E)-2-(4-methoxyphenyl)ethenyl]amino]carbonyl]-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-3-hydroxy-2-{[(E)-2-(4-methoxyphenyl)vinyl]carbamoyl}-2-butenoate [ACD/IUPAC Name]
Ethyl-(2E)-3-hydroxy-2-{[(E)-2-(4-methoxyphenyl)vinyl]carbamoyl}-2-butenoat [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: 538.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.8±3.0 kJ/mol
Flash Point: 279.2±30.1 °C
Index of Refraction: 1.571
Molar Refractivity: 83.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.37
ACD/LogD (pH 5.5): 2.00
ACD/BCF (pH 5.5): 18.71
ACD/KOC (pH 5.5): 268.04
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 1.27
ACD/KOC (pH 7.4): 18.15
Polar Surface Area: 85 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 253.6±3.0 cm3

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