ChemSpider 2D Image | (7aR,10aS)-5-[(~2~H_3_)Methyloxy]-3,4,7a,10a-tetrahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromene-1,12-dione | C17H9D3O7

(7aR,10aS)-5-[(2H3)Methyloxy]-3,4,7a,10a-tetrahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromene-1,12-dione

  • Molecular FormulaC17H9D3O7
  • Average mass331.292 Da
  • Monoisotopic mass331.077118 Da
  • ChemSpider ID48058847

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(7aR,10aS)-5-[(2H3)Methyloxy]-3,4,7a,10a-tetrahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromen-1,12-dion [German] [ACD/IUPAC Name]
(7aR,10aS)-5-[(2H3)Methyloxy]-3,4,7a,10a-tetrahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromene-1,12-dione [ACD/IUPAC Name]
(7aR,10aS)-5-[(2H3)Méthyloxy]-3,4,7a,10a-tétrahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromène-1,12-dione [French] [ACD/IUPAC Name]
1H,12H-Furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c][1]benzopyran-1,12-dione, 3,4,7a,10a-tetrahydro-5-(methyl-d3-oxy)-, (7aR,10aS)- [ACD/Index Name]
1217610-02-0 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 612.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.9±3.0 kJ/mol
Flash Point: 274.1±31.5 °C
Index of Refraction: 1.680
Molar Refractivity: 77.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.17
ACD/LogD (pH 5.5): 0.73
ACD/BCF (pH 5.5): 2.10
ACD/KOC (pH 5.5): 59.22
ACD/LogD (pH 7.4): 0.73
ACD/BCF (pH 7.4): 2.10
ACD/KOC (pH 7.4): 59.22
Polar Surface Area: 80 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 70.1±5.0 dyne/cm
Molar Volume: 205.7±5.0 cm3

Click to predict properties on the Chemicalize site


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