ChemSpider 2D Image | 3-[(Tetrahydro-2-furanylmethyl)sulfanyl]propanoic acid | C8H14O3S

3-[(Tetrahydro-2-furanylmethyl)sulfanyl]propanoic acid

  • Molecular FormulaC8H14O3S
  • Average mass190.260 Da
  • Monoisotopic mass190.066360 Da
  • ChemSpider ID24147039

More details:

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

3-[(Tetrahydro-2-furanylmethyl)sulfanyl]propanoic acid [ACD/IUPAC Name]
3-[(Tetrahydro-2-furanylmethyl)sulfanyl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[(tétrahydro-2-furanylméthyl)sulfanyl]propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[[(tetrahydro-2-furanyl)methyl]thio]- [ACD/Index Name]
3-[(OXOLAN-2-YLMETHYL)SULFANYL]PROPANOIC ACID
3-[(tetrahydrofuran-2-ylmethyl)thio]propanoic acid
3-{[(OXOLAN-2-YL)METHYL]SULFANYL}PROPANOIC ACID
933699-81-1 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 351.7±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 65.5±6.0 kJ/mol
Flash Point: 166.5±20.9 °C
Index of Refraction: 1.519
Molar Refractivity: 48.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.52
ACD/LogD (pH 5.5): -0.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.46
ACD/LogD (pH 7.4): -1.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 72 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 158.9±3.0 cm3

Click to predict properties on the Chemicalize site


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