ChemSpider 2D Image | Ethyl 3-bromo-3-oxetanecarboxylate | C6H9BrO3

Ethyl 3-bromo-3-oxetanecarboxylate

  • Molecular FormulaC6H9BrO3
  • Average mass209.038 Da
  • Monoisotopic mass207.973495 Da
  • ChemSpider ID57373413

More details:






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

1353777-56-6 [RN]
3-Bromo-3-oxétanecarboxylate d'éthyle [French] [ACD/IUPAC Name]
3-Oxetanecarboxylic acid, 3-bromo-, ethyl ester [ACD/Index Name]
Ethyl 3-bromo-3-oxetanecarboxylate [ACD/IUPAC Name]
Ethyl 3-bromooxetane-3-carboxylate
Ethyl-3-brom-3-oxetancarboxylat [German] [ACD/IUPAC Name]
MFCD23161750

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 199.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.4 mmHg at 25°C
Enthalpy of Vaporization: 43.6±3.0 kJ/mol
Flash Point: 74.4±27.3 °C
Index of Refraction: 1.512
Molar Refractivity: 38.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.09
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 5.92
ACD/KOC (pH 5.5): 124.26
ACD/LogD (pH 7.4): 1.32
ACD/BCF (pH 7.4): 5.92
ACD/KOC (pH 7.4): 124.26
Polar Surface Area: 36 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 128.9±3.0 cm3

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