Found 477 results

Search term: MF = 'C_{16}H_{19}BrO_{4}'
ChemSpider 2D Image | Methyl (2Z)-3-bromo-4-oxo-4-[4-(pentyloxy)phenyl]-2-butenoate | C16H19BrO4

Methyl (2Z)-3-bromo-4-oxo-4-[4-(pentyloxy)phenyl]-2-butenoate

  • Molecular FormulaC16H19BrO4
  • Average mass355.224 Da
  • Monoisotopic mass354.046661 Da
  • ChemSpider ID34970563

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-Bromo-4-oxo-4-[4-(pentyloxy)phényl]-2-buténoate de méthyle [French] [ACD/IUPAC Name]
2-Butenoic acid, 3-bromo-4-oxo-4-[4-(pentyloxy)phenyl]-, methyl ester, (2Z)- [ACD/Index Name]
Methyl (2Z)-3-bromo-4-oxo-4-[4-(pentyloxy)phenyl]-2-butenoate [ACD/IUPAC Name]
Methyl-(2Z)-3-brom-4-oxo-4-[4-(pentyloxy)phenyl]-2-butenoat [German] [ACD/IUPAC 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: 437.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.4±3.0 kJ/mol
Flash Point: 218.4±28.7 °C
Index of Refraction: 1.539
Molar Refractivity: 84.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 569.14
ACD/KOC (pH 5.5): 3264.28
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 569.14
ACD/KOC (pH 7.4): 3264.28
Polar Surface Area: 53 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 270.6±3.0 cm3

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