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Search term: STZFTMXKJRIOSV (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-Methyl-3-oxo-1H,3H-pyrano[3,4-c]pyran-4-carbaldehyde | C10H8O4

1-Methyl-3-oxo-1H,3H-pyrano[3,4-c]pyran-4-carbaldehyde

  • Molecular FormulaC10H8O4
  • Average mass192.168 Da
  • Monoisotopic mass192.042252 Da
  • ChemSpider ID24689881

More details:

Featured data source
Natural Product Updates

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

1H,3H-Pyrano[3,4-c]pyran-4-carboxaldehyde, 1-methyl-3-oxo- [ACD/Index Name]
1-Methyl-3-oxo-1H,3H-pyrano[3,4-c]pyran-4-carbaldehyd [German] [ACD/IUPAC Name]
1-Methyl-3-oxo-1H,3H-pyrano[3,4-c]pyran-4-carbaldehyde [ACD/IUPAC Name]
1-Méthyl-3-oxo-1H,3H-pyrano[3,4-c]pyrane-4-carbaldéhyde [French] [ACD/IUPAC Name]
1078719-64-8 [RN]
fagraldehyde
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL456558/
MFCD24686708

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

Density: 1.3±0.1 g/cm3
Boiling Point: 405.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.8±3.0 kJ/mol
Flash Point: 186.4±28.8 °C
Index of Refraction: 1.572
Molar Refractivity: 47.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -2.30
ACD/LogD (pH 5.5): -0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.43
ACD/LogD (pH 7.4): -0.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.43
Polar Surface Area: 53 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 47.0±5.0 dyne/cm
Molar Volume: 143.6±5.0 cm3

Click to predict properties on the Chemicalize site


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