ChemSpider 2D Image | O~3~-[(2R)-2,6-Dihydroxy-2-(2-methoxy-2-oxoethyl)-6-methylheptanoyl](21-~13~C,21,21,21-~2~H_3_)cephalotaxine | C2813CH36D3NO9

O3-[(2R)-2,6-Dihydroxy-2-(2-methoxy-2-oxoethyl)-6-methylheptanoyl](21-13C,21,21,21-2H3)cephalotaxine

  • Molecular FormulaC2813CH36D3NO9
  • Average mass549.632 Da
  • Monoisotopic mass549.284668 Da
  • ChemSpider ID48062577

  • defined stereocentres - 4 of 4 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

Cephalotaxine-21-13C-21,21,21-d3, O3-[(2R)-2,6-dihydroxy-2-(2-methoxy-2-oxoethyl)-6-methyl-1-oxoheptyl]- [ACD/Index Name]
O3-[(2R)-2,6-Dihydroxy-2-(2-methoxy-2-oxoethyl)-6-methylheptanoyl](21-13C,21,21,21-2H3)cephalotaxin [German] [ACD/IUPAC Name]
O3-[(2R)-2,6-Dihydroxy-2-(2-methoxy-2-oxoethyl)-6-methylheptanoyl](21-13C,21,21,21-2H3)cephalotaxine [ACD/IUPAC Name]
O3-[(2R)-2,6-Dihydroxy-2-(2-méthoxy-2-oxoéthyl)-6-méthylheptanoyl](21-13C,21,21,21-2H3)cephalotaxine [French] [ACD/IUPAC Name]
1217626-64-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 140.6±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: 55.7±0.5 10-24cm3
Surface Tension: 61.3±5.0 dyne/cm
Molar Volume: 408.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement