Found 297 results

Search term: MF = 'C_{16}H_{17}BrO_{4}'
ChemSpider 2D Image | 2-Oxocyclohexyl (2E)-3-(5-bromo-2-methoxyphenyl)acrylate | C16H17BrO4

2-Oxocyclohexyl (2E)-3-(5-bromo-2-methoxyphenyl)acrylate

  • Molecular FormulaC16H17BrO4
  • Average mass353.208 Da
  • Monoisotopic mass352.031006 Da
  • ChemSpider ID23735934

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(5-Bromo-2-méthoxyphényl)acrylate de 2-oxocyclohexyle [French] [ACD/IUPAC Name]
2-Oxocyclohexyl (2E)-3-(5-bromo-2-methoxyphenyl)acrylate [ACD/IUPAC Name]
2-Oxocyclohexyl-(2E)-3-(5-brom-2-methoxyphenyl)acrylat [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-(5-bromo-2-methoxyphenyl)-, 2-oxocyclohexyl ester, (2E)- [ACD/Index Name]
2-OXOCYCLOHEXYL (2E)-3-(5-BROMO-2-METHOXYPHENYL)PROP-2-ENOATE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 472.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.6±3.0 kJ/mol
Flash Point: 239.8±28.7 °C
Index of Refraction: 1.578
Molar Refractivity: 82.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 3.27
ACD/BCF (pH 5.5): 180.95
ACD/KOC (pH 5.5): 1437.35
ACD/LogD (pH 7.4): 3.27
ACD/BCF (pH 7.4): 180.95
ACD/KOC (pH 7.4): 1437.35
Polar Surface Area: 53 Å2
Polarizability: 32.6±0.5 10-24cm3
Surface Tension: 50.3±5.0 dyne/cm
Molar Volume: 248.1±5.0 cm3

Click to predict properties on the Chemicalize site


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