Found 33 results

Search term: MF = 'C_{6}H_{9}O_{2}'
ChemSpider 2D Image | (2E)-3-Methyl-4-oxo-2-penten-2-olate | C6H9O2

(2E)-3-Methyl-4-oxo-2-penten-2-olate

  • Molecular FormulaC6H9O2
  • Average mass113.135 Da
  • Monoisotopic mass113.060806 Da
  • ChemSpider ID77431367

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-Methyl-4-oxo-2-penten-2-olat [German] [ACD/IUPAC Name]
(2E)-3-Methyl-4-oxo-2-penten-2-olate [ACD/IUPAC Name]
(2E)-3-Méthyl-4-oxo-2-pentén-2-olate [French] [ACD/IUPAC Name]
3-Penten-2-one, 4-hydroxy-3-methyl-, ion(1-), (3E)- [ACD/Index Name]

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

Density:
Boiling Point: 204.3±32.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.9 mmHg at 25°C
Enthalpy of Vaporization: 51.2±6.0 kJ/mol
Flash Point: 80.4±17.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.84
ACD/LogD (pH 5.5): 0.85
ACD/BCF (pH 5.5): 2.58
ACD/KOC (pH 5.5): 68.61
ACD/LogD (pH 7.4): 0.84
ACD/BCF (pH 7.4): 2.56
ACD/KOC (pH 7.4): 68.00
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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