Found 92 results

Search term: MF = 'C_{12}H_{12}O_{7}'
ChemSpider 2D Image | Dimethyl 5,7-dihydroxy-3-methyl-6-oxo-2,4,7-cycloheptatriene-1,2-dicarboxylate | C12H12O7

Dimethyl 5,7-dihydroxy-3-methyl-6-oxo-2,4,7-cycloheptatriene-1,2-dicarboxylate

  • Molecular FormulaC12H12O7
  • Average mass268.220 Da
  • Monoisotopic mass268.058289 Da
  • ChemSpider ID57427578

More details:

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

2,4,7-Cycloheptatriene-1,2-dicarboxylic acid, 5,7-dihydroxy-3-methyl-6-oxo-, dimethyl ester [ACD/Index Name]
5,7-Dihydroxy-3-méthyl-6-oxo-2,4,7-cycloheptatriène-1,2-dicarboxylate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5,7-dihydroxy-3-methyl-6-oxo-2,4,7-cycloheptatriene-1,2-dicarboxylate [ACD/IUPAC Name]
Dimethyl-5,7-dihydroxy-3-methyl-6-oxo-2,4,7-cycloheptatrien-1,2-dicarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 384.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 73.2±6.0 kJ/mol
Flash Point: 144.2±21.4 °C
Index of Refraction: 1.594
Molar Refractivity: 61.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.22
ACD/LogD (pH 5.5): -1.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 110 Å2
Polarizability: 24.2±0.5 10-24cm3
Surface Tension: 67.7±3.0 dyne/cm
Molar Volume: 179.7±3.0 cm3

Click to predict properties on the Chemicalize site


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