ChemSpider 2D Image | olivin | C20H22O9

olivin

  • Molecular FormulaC20H22O9
  • Average mass406.383 Da
  • Monoisotopic mass406.126373 Da
  • ChemSpider ID21490454

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1S)-5-Deoxy-1-O-methyl-1-C-[(2R,3S)-3,5,7,10-tetrahydroxy-4-oxo-1,2,3,4-tetrahydro-2-anthracenyl]-D-xylulose [ACD/IUPAC Name]
(1S)-5-Désoxy-1-O-méthyl-1-C-[(2R,3S)-3,5,7,10-tétrahydroxy-4-oxo-1,2,3,4-tétrahydro-2-anthracényl]-D-xylulose [French] [ACD/IUPAC Name]
D-threo-2-Pentulose, 5-deoxy-1-O-methyl-1-C-[(2R,3S)-1,2,3,4-tetrahydro-3,5,7,10-tetrahydroxy-4-oxo-2-anthracenyl]-, (1S)- [ACD/Index Name]
olivin
(1S)-5-deoxy-1-O-methyl-1-C-[(2R,3S)-3,5,7,10-tetrahydroxy-4-oxo-1,2,3,4-tetrahydroanthracen-2-yl]-D-xylulose
(2S,3R)-3-[(1S,3S,4R)-3,4-DIHYDROXY-1-METHOXY-2-OXOPENTYL]-2,6,8,9-TETRAHYDROXY-1,2,3,4-TETRAHYDROANTHRACEN-1-ONE
6680-06-4 [RN]

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

2067481 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 789.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.4±3.0 kJ/mol
Flash Point: 281.9±26.4 °C
Index of Refraction: 1.702
Molar Refractivity: 100.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.68
ACD/LogD (pH 5.5): 0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.14
ACD/LogD (pH 7.4): -1.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 165 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 87.4±3.0 dyne/cm
Molar Volume: 260.0±3.0 cm3

Click to predict properties on the Chemicalize site


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