ChemSpider 2D Image | (3S)-oxolane-3-carboxylic acid | C5H8O3

(3S)-oxolane-3-carboxylic acid

  • Molecular FormulaC5H8O3
  • Average mass116.115 Da
  • Monoisotopic mass116.047340 Da
  • ChemSpider ID21374191

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-oxolane-3-carboxylic acid
(3S)-Tetrahydro-3-furancarbonsäure [German] [ACD/IUPAC Name]
(3S)-Tetrahydro-3-furancarboxylic acid [ACD/IUPAC Name]
(3S)-Tetrahydrofuran-3-carboxylic acid
(S)-Tetrahydrofuran-3-carboxylic acid
168395-26-4 [RN]
3-Furancarboxylic acid, tetrahydro-, (3S)- [ACD/Index Name]
Acide (3S)-tétrahydro-3-furanecarboxylique [French] [ACD/IUPAC Name]
(S) -Tetrahydro-3-furancarboxylic acid
(S)-(-)-Tetrahydrofuran-3-carboxylic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.3±0.1 g/cm3
Boiling Point: 252.1±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 53.9±6.0 kJ/mol
Flash Point: 113.2±18.9 °C
Index of Refraction: 1.480
Molar Refractivity: 26.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.51
ACD/LogD (pH 5.5): -1.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 47 Å2
Polarizability: 10.4±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 92.0±3.0 cm3

Click to predict properties on the Chemicalize site


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