Found 33 results

Search term: MF = 'C_{6}H_{9}O_{2}'
ChemSpider 2D Image | (3Z)-5-Oxo-3-hexen-3-olate | C6H9O2

(3Z)-5-Oxo-3-hexen-3-olate

  • Molecular FormulaC6H9O2
  • Average mass113.135 Da
  • Monoisotopic mass113.060806 Da
  • ChemSpider ID95603986

  • Charge - Charge

More details:

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

(3Z)-5-Oxo-3-hexen-3-olat [German] [ACD/IUPAC Name]
(3Z)-5-Oxo-3-hexen-3-olate [ACD/IUPAC Name]
(3Z)-5-Oxo-3-hexén-3-olate [French] [ACD/IUPAC Name]
3-Hexen-2-one, 4-hydroxy-, ion(1-), (3Z)- [ACD/Index Name]

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

Density:
Boiling Point: 201.0±32.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.8 mmHg at 25°C
Enthalpy of Vaporization: 50.9±6.0 kJ/mol
Flash Point: 78.8±17.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.82
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 2.08
ACD/KOC (pH 5.5): 58.83
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 1.98
ACD/KOC (pH 7.4): 55.92
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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