ChemSpider 2D Image | 3'-Hydroxy-2',4,4',5'-tetraoxo-3,4-dihydrospiro[chromene-2,1'-cyclopentane]-6-carbonitrile | C14H7NO6

3'-Hydroxy-2',4,4',5'-tetraoxo-3,4-dihydrospiro[chromene-2,1'-cyclopentane]-6-carbonitrile

  • Molecular FormulaC14H7NO6
  • Average mass285.208 Da
  • Monoisotopic mass285.027344 Da
  • ChemSpider ID86575685

More details:

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

3'-Hydroxy-2',4,4',5'-tetraoxo-3,4-dihydrospiro[chromene-2,1'-cyclopentane]-6-carbonitril [German] [ACD/IUPAC Name]
3'-Hydroxy-2',4,4',5'-tetraoxo-3,4-dihydrospiro[chromene-2,1'-cyclopentane]-6-carbonitrile [ACD/IUPAC Name]
3'-Hydroxy-2',4,4',5'-tétraoxo-3,4-dihydrospiro[chromene-2,1'-cyclopentane]-6-carbonitrile [French] [ACD/IUPAC Name]
Spiro[2H-1-benzopyran-2,1'-cyclopentane]-6-carbonitrile, 3,4-dihydro-3'-hydroxy-2',4,4',5'-tetraoxo- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 649.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 346.8±31.5 °C
Index of Refraction: 1.671
Molar Refractivity: 63.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.29
ACD/LogD (pH 5.5): -2.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 91.0±5.0 dyne/cm
Molar Volume: 169.4±5.0 cm3

Click to predict properties on the Chemicalize site


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