ChemSpider 2D Image | (5-Bromo-3-thienyl)methyl 3-(tetrahydro-2-furanyl)propanoate | C12H15BrO3S

(5-Bromo-3-thienyl)methyl 3-(tetrahydro-2-furanyl)propanoate

  • Molecular FormulaC12H15BrO3S
  • Average mass319.215 Da
  • Monoisotopic mass317.992523 Da
  • ChemSpider ID26072572

More details:

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

(5-Brom-3-thienyl)methyl-3-(tetrahydro-2-furanyl)propanoat [German] [ACD/IUPAC Name]
(5-Bromo-3-thienyl)methyl 3-(tetrahydro-2-furanyl)propanoate [ACD/IUPAC Name]
2-Furanpropanoic acid, tetrahydro-, (5-bromo-3-thienyl)methyl ester [ACD/Index Name]
3-(Tétrahydro-2-furanyl)propanoate de (5-bromo-3-thiényl)méthyle [French] [ACD/IUPAC Name]
(5-BROMOTHIOPHEN-3-YL)METHYL 3-(OXOLAN-2-YL)PROPANOATE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 386.4±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 187.5±23.7 °C
Index of Refraction: 1.558
Molar Refractivity: 71.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 202.05
ACD/KOC (pH 5.5): 1555.46
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 202.05
ACD/KOC (pH 7.4): 1555.46
Polar Surface Area: 64 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 47.8±3.0 dyne/cm
Molar Volume: 220.2±3.0 cm3

Click to predict properties on the Chemicalize site


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