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Search term: MF = 'C_{8}H_{9}BrO_{3}'

ChemSpider 2D Image | Propyl 5-bromo-2-furoate | C8H9BrO3

Propyl 5-bromo-2-furoate

  • Molecular FormulaC8H9BrO3
  • Average mass233.059 Da
  • Monoisotopic mass231.973495 Da
  • ChemSpider ID28675711

More details:






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

2-Furancarboxylic acid, 5-bromo-, propyl ester [ACD/Index Name]
5-Bromo-2-furoate de propyle [French] [ACD/IUPAC Name]
Propyl 5-bromo-2-furoate [ACD/IUPAC Name]
Propyl-5-brom-2-furoat [German] [ACD/IUPAC Name]
114430-36-3 [RN]
Propyl 5-bromofuran-2-carboxylate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 260.2±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.8±3.0 kJ/mol
Flash Point: 111.2±21.8 °C
Index of Refraction: 1.505
Molar Refractivity: 47.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 69.19
ACD/KOC (pH 5.5): 722.31
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 69.19
ACD/KOC (pH 7.4): 722.31
Polar Surface Area: 39 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 38.2±3.0 dyne/cm
Molar Volume: 159.3±3.0 cm3

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