ChemSpider 2D Image | 4-Oxo-1-butanolate | C4H7O2

4-Oxo-1-butanolate

  • Molecular FormulaC4H7O2
  • Average mass87.098 Da
  • Monoisotopic mass87.045151 Da
  • ChemSpider ID77419254

  • Charge - Charge

More details:

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

4-Oxo-1-butanolat [German] [ACD/IUPAC Name]
4-Oxo-1-butanolate [ACD/IUPAC Name]
4-Oxo-1-butanolate [French] [ACD/IUPAC Name]
Butanal, 4-hydroxy-, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point: 196.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.8 mmHg at 25°C
Enthalpy of Vaporization: 50.4±6.0 kJ/mol
Flash Point: 76.5±15.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.57
ACD/LogD (pH 5.5): -0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 17.72
ACD/LogD (pH 7.4): -0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.72
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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