ChemSpider 2D Image | 3-Hydroxy-1,1-cyclobutanedicarboxylic acid | C6H8O5

3-Hydroxy-1,1-cyclobutanedicarboxylic acid

  • Molecular FormulaC6H8O5
  • Average mass160.125 Da
  • Monoisotopic mass160.037170 Da
  • ChemSpider ID28575224

More details:






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

1,1-Cyclobutanedicarboxylic acid, 3-hydroxy- [ACD/Index Name]
3-Hydroxy-1,1-cyclobutandicarbonsäure [German] [ACD/IUPAC Name]
3-Hydroxy-1,1-cyclobutanedicarboxylic acid [ACD/IUPAC Name]
Acide 3-hydroxy-1,1-cyclobutanedicarboxylique [French] [ACD/IUPAC Name]
3-Hydroxycyclobutane-1,1-dicarboxylic acid
827032-76-8 [RN]
MFCD20639601

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.8±0.1 g/cm3
Boiling Point: 454.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±6.0 kJ/mol
Flash Point: 243.0±25.2 °C
Index of Refraction: 1.626
Molar Refractivity: 32.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.09
ACD/LogD (pH 5.5): -3.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability: 12.7±0.5 10-24cm3
Surface Tension: 112.9±3.0 dyne/cm
Molar Volume: 90.9±3.0 cm3

Click to predict properties on the Chemicalize site






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