ChemSpider 2D Image | 3',6'-Dihydroxy-3-oxo-N-(2-propyn-1-yl)-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxamide | C24H15NO6

3',6'-Dihydroxy-3-oxo-N-(2-propyn-1-yl)-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxamide

  • Molecular FormulaC24H15NO6
  • Average mass413.379 Da
  • Monoisotopic mass413.089935 Da
  • ChemSpider ID60598251

More details:

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

3',6'-Dihydroxy-3-oxo-N-(2-propin-1-yl)-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxamid [German] [ACD/IUPAC Name]
3',6'-Dihydroxy-3-oxo-N-(2-propyn-1-yl)-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxamide [ACD/IUPAC Name]
3',6'-Dihydroxy-3-oxo-N-(2-propyn-1-yl)-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxamide [French] [ACD/IUPAC Name]
Spiro[isobenzofuran-1(3H),9'-[9H]xanthene]-6-carboxamide, 3',6'-dihydroxy-3-oxo-N-2-propyn-1-yl- [ACD/Index Name]
3',6'-dihydroxy-3-oxo-N-(prop-2-yn-1-yl)-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxamide
3',6'-dihydroxy-3-oxo-N-(prop-2-yn-1-yl)spiro[2-benzofuran-1,9'-xanthene]-6-carboxamide
478801-49-9 [RN]
FAM alkyne 6-isomer
FAM alkyne, 6-isomer

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

Density: 1.6±0.1 g/cm3
Boiling Point: 722.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.3±3.0 kJ/mol
Flash Point: 390.7±32.9 °C
Index of Refraction: 1.767
Molar Refractivity: 108.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 87.11
ACD/KOC (pH 5.5): 851.72
ACD/LogD (pH 7.4): 2.85
ACD/BCF (pH 7.4): 86.09
ACD/KOC (pH 7.4): 841.75
Polar Surface Area: 105 Å2
Polarizability: 42.8±0.5 10-24cm3
Surface Tension: 93.5±5.0 dyne/cm
Molar Volume: 260.8±5.0 cm3

Click to predict properties on the Chemicalize site


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