ChemSpider 2D Image | (2R,3R)-2-(3,4-Dihydroxyphenyl)-3,5,7-(2,4-~13~C_2_,4,4-~2~H_2_)chromanetriol | C1313C2H12D2O6


  • Molecular FormulaC1313C2H12D2O6
  • Average mass294.266 Da
  • Monoisotopic mass294.098297 Da
  • ChemSpider ID107450415
  • 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

(2R,3R)-2-(3,4-Dihydroxyphenyl)-3,5,7-(2,4-13C2,4,4-2H2)chromanetriol [ACD/IUPAC Name]
(2R,3R)-2-(3,4-Dihydroxyphényl)-3,5,7-(2,4-13C2,4,4-2H2)chromanetriol [French] [ACD/IUPAC Name]
(2R,3R)-2-(3,4-Dihydroxyphenyl)-3,5,7-(2,4-13C2,4,4-2H2)chromantriol [German] [ACD/IUPAC Name]
2H-1-Benzopyran-4-d-3,5,7-triol-2,4-13C2, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-4-d-, (2R,3R)- [ACD/Index Name]

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: 1.742
Molar Refractivity: 73.6±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
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: 29.2±0.5 10-24cm3
Surface Tension: 88.1±3.0 dyne/cm
Molar Volume: 182.2±3.0 cm3

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