ChemSpider 2D Image | 9-[(~2~H_3_)Methyloxy]-7H-furo[3,2-g]chromen-7-one | C12H5D3O4

9-[(2H3)Methyloxy]-7H-furo[3,2-g]chromen-7-one

  • Molecular FormulaC12H5D3O4
  • Average mass219.208 Da
  • Monoisotopic mass219.061096 Da
  • ChemSpider ID29738786

  • Non-standard isotope - Non-standard isotope

More details:

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

7H-Furo[3,2-g][1]benzopyran-7-one, 9-(methyl-d3-oxy)- [ACD/Index Name]
9-[(2H3)Methyloxy]-7H-furo[3,2-g]chromen-7-on [German] [ACD/IUPAC Name]
9-[(2H3)Methyloxy]-7H-furo[3,2-g]chromen-7-one [ACD/IUPAC Name]
9-[(2H3)Méthyloxy]-7H-furo[3,2-g]chromén-7-one [French] [ACD/IUPAC Name]
80386-99-8 [RN]
9-(²H?)methoxyfuro[3,2-g]chromen-7-one
Methoxsalen-d3
MFCD08063558 [MDL number]
SS-4511

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

Density: 1.4±0.1 g/cm3
Boiling Point: 414.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.8±3.0 kJ/mol
Flash Point: 204.7±28.7 °C
Index of Refraction: 1.635
Molar Refractivity: 56.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.79
ACD/KOC (pH 5.5): 284.15
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 18.79
ACD/KOC (pH 7.4): 284.15
Polar Surface Area: 49 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 158.0±3.0 cm3

Click to predict properties on the Chemicalize site


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