ChemSpider 2D Image | Methyl (3S)-3-bromotetrahydro-3-furancarboxylate | C6H9BrO3

Methyl (3S)-3-bromotetrahydro-3-furancarboxylate

  • Molecular FormulaC6H9BrO3
  • Average mass209.038 Da
  • Monoisotopic mass207.973495 Da
  • ChemSpider ID122904379

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Bromotétrahydro-3-furanecarboxylate de méthyle [French] [ACD/IUPAC Name]
3-Furancarboxylic acid, 3-bromotetrahydro-, methyl ester, (3S)- [ACD/Index Name]
Methyl (3S)-3-bromotetrahydro-3-furancarboxylate [ACD/IUPAC Name]
Methyl-(3S)-3-bromtetrahydro-3-furancarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 207.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.4±3.0 kJ/mol
Flash Point: 79.4±27.3 °C
Index of Refraction: 1.506
Molar Refractivity: 38.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.62
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 3.14
ACD/KOC (pH 5.5): 78.89
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 3.14
ACD/KOC (pH 7.4): 78.89
Polar Surface Area: 36 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 130.2±3.0 cm3

Click to predict properties on the Chemicalize site


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