ChemSpider 2D Image | trans-3-Hydroxycyclobutanecarboxylic acid | C5H8O3

trans-3-Hydroxycyclobutanecarboxylic acid

  • Molecular FormulaC5H8O3
  • Average mass116.115 Da
  • Monoisotopic mass116.047340 Da
  • ChemSpider ID27471227

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

Acide trans-3-hydroxycyclobutanecarboxylique [French] [ACD/IUPAC Name]
Cyclobutanecarboxylic acid, 3-hydroxy-, trans- [ACD/Index Name]
trans-3-Hydroxycyclobutancarbonsäure [German] [ACD/IUPAC Name]
trans-3-Hydroxycyclobutanecarboxylic acid [ACD/IUPAC Name]
1268521-85-2 [RN]
552849-33-9 [RN]
MFCD12964956 [MDL number]
MFCD17676395 [MDL number]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 290.1±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 61.4±6.0 kJ/mol
Flash Point: 143.5±21.9 °C
Index of Refraction: 1.565
Molar Refractivity: 26.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.80
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.34
ACD/LogD (pH 7.4): -3.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 10.4±0.5 10-24cm3
Surface Tension: 74.6±3.0 dyne/cm
Molar Volume: 80.2±3.0 cm3

Click to predict properties on the Chemicalize site


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