ChemSpider 2D Image | (2S)-2-Oxetanecarboxylic acid | C4H6O3

(2S)-2-Oxetanecarboxylic acid

  • Molecular FormulaC4H6O3
  • Average mass102.089 Da
  • Monoisotopic mass102.031693 Da
  • ChemSpider ID32799240

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Oxetancarbonsäure [German] [ACD/IUPAC Name]
(2S)-2-Oxetanecarboxylic acid [ACD/IUPAC Name]
(2S)-oxetane-2-carboxylic acid
2241107-29-7 [RN]
2-Oxetanecarboxylic acid, (2S)- [ACD/Index Name]
Acide (2S)-2-oxétanecarboxylique [French] [ACD/IUPAC Name]
(S)-oxetane-2-carboxylic acid
MFCD31690962

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

Density: 1.4±0.1 g/cm3
Boiling Point: 244.2±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 53.0±6.0 kJ/mol
Flash Point: 115.1±18.9 °C
Index of Refraction: 1.492
Molar Refractivity: 21.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.87
ACD/LogD (pH 5.5): -2.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 47 Å2
Polarizability: 8.5±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 74.3±3.0 cm3

Click to predict properties on the Chemicalize site


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