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Search term: MF = 'C_{14}H_{18}BrNO_{5}'

ChemSpider 2D Image | Methyl 3-bromo-4-{2-[(1-methoxy-2-propanyl)amino]-2-oxoethoxy}benzoate | C14H18BrNO5

Methyl 3-bromo-4-{2-[(1-methoxy-2-propanyl)amino]-2-oxoethoxy}benzoate

  • Molecular FormulaC14H18BrNO5
  • Average mass360.200 Da
  • Monoisotopic mass359.036835 Da
  • ChemSpider ID30444264

More details:






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

3-Bromo-4-{2-[(1-méthoxy-2-propanyl)amino]-2-oxoéthoxy}benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-4-[2-[(2-methoxy-1-methylethyl)amino]-2-oxoethoxy]-, methyl ester [ACD/Index Name]
Methyl 3-bromo-4-{2-[(1-methoxy-2-propanyl)amino]-2-oxoethoxy}benzoate [ACD/IUPAC Name]
Methyl-3-brom-4-{2-[(1-methoxy-2-propanyl)amino]-2-oxoethoxy}benzoat [German] [ACD/IUPAC 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: 511.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 263.0±30.1 °C
Index of Refraction: 1.528
Molar Refractivity: 80.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.47
ACD/BCF (pH 5.5): 44.68
ACD/KOC (pH 5.5): 528.19
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 44.68
ACD/KOC (pH 7.4): 528.19
Polar Surface Area: 74 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 262.7±3.0 cm3

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