ChemSpider 2D Image | (6aR,9aS)-4-[(~13~C)Methyloxy](1,2,3,3a,3b,4,5,5a,6a,9,9a,9b,9c,11,11a-~13~C_15_)-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione | C13C16H12O6

(6aR,9aS)-4-[(13C)Methyloxy](1,2,3,3a,3b,4,5,5a,6a,9,9a,9b,9c,11,11a-13C15)-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione

  • Molecular FormulaC13C16H12O6
  • Average mass328.156 Da
  • Monoisotopic mass328.117065 Da
  • ChemSpider ID57579790

  • 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

(6aR,9aS)-4-[(13C)Methyloxy](1,2,3,3a,3b,4,5,5a,6a,9,9a,9b,9c,11,11a-13C15)-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromen-1,11-dion [German] [ACD/IUPAC Name]
(6aR,9aS)-4-[(13C)Methyloxy](1,2,3,3a,3b,4,5,5a,6a,9,9a,9b,9c,11,11a-13C15)-2,3,6a,9a-tetrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromene-1,11-dione [ACD/IUPAC Name]
(6aR,9aS)-4-[(13C)Méthyloxy](1,2,3,3a,3b,4,5,5a,6a,9,9a,9b,9c,11,11a-13C15)-2,3,6a,9a-tétrahydrocyclopenta[c]furo[3',2':4,5]furo[2,3-h]chromène-1,11-dione [French] [ACD/IUPAC Name]
Cyclopenta[c]furo[3',2':4,5]furo[2,3-h][1]benzopyran-1,11-dione-1,2,3,3a,3b,4,5,5a,6a,9,9a,9b,9c,11,11a-13C15, 2,3,6a,9a-tetrahydro-4-(methyl-13C-oxy)-, (6aR,9aS)- [ACD/Index Name]
1217449-45-0 [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.687
Molar Refractivity: 76.0±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 68.7±5.0 dyne/cm
Molar Volume: 199.6±5.0 cm3

Click to predict properties on the Chemicalize site


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