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Search term: MF = 'C_{16}H_{19}BrO_{4}'
ChemSpider 2D Image | 2-[(4-Methylcyclohexyl)oxy]-2-oxoethyl 2-bromobenzoate | C16H19BrO4

2-[(4-Methylcyclohexyl)oxy]-2-oxoethyl 2-bromobenzoate

  • Molecular FormulaC16H19BrO4
  • Average mass355.224 Da
  • Monoisotopic mass354.046661 Da
  • ChemSpider ID67202115

More details:

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

2-[(4-Methylcyclohexyl)oxy]-2-oxoethyl 2-bromobenzoate [ACD/IUPAC Name]
2-[(4-Methylcyclohexyl)oxy]-2-oxoethyl-2-brombenzoat [German] [ACD/IUPAC Name]
2-Bromobenzoate de 2-[(4-méthylcyclohexyl)oxy]-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-bromo-, 2-[(4-methylcyclohexyl)oxy]-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 439.5±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 219.6±23.2 °C
Index of Refraction: 1.557
Molar Refractivity: 82.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 4.63
ACD/BCF (pH 5.5): 1941.99
ACD/KOC (pH 5.5): 7858.23
ACD/LogD (pH 7.4): 4.63
ACD/BCF (pH 7.4): 1941.99
ACD/KOC (pH 7.4): 7858.23
Polar Surface Area: 53 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 47.9±5.0 dyne/cm
Molar Volume: 255.8±5.0 cm3

Click to predict properties on the Chemicalize site


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