ChemSpider 2D Image | (−)-Dolabriferol | C21H38O6

(−)-Dolabriferol

  • Molecular FormulaC21H38O6
  • Average mass386.523 Da
  • Monoisotopic mass386.266846 Da
  • ChemSpider ID27289083
  • defined stereocentres - 8 of 8 defined stereocentres


More details:



Featured data source



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

(−)-Dolabriferol
(5S)-2,4-Dideoxy-1-C-ethyl-3-O-[(2R,3R,4S)-3-hydroxy-2,4-dimethyl-5-oxoheptanoyl]-5-isopropyl-2,4-dimethyl-α-L-ribopyranose [ACD/IUPAC Name]
(5S)-2,4-Didesoxy-1-C-ethyl-3-O-[(2R,3R,4S)-3-hydroxy-2,4-dimethyl-5-oxoheptanoyl]-5-isopropyl-2,4-dimethyl-α-L-ribopyranose [German] [ACD/IUPAC Name]
(5S)-2,4-Didésoxy-1-C-éthyl-3-O-[(2R,3R,4S)-3-hydroxy-2,4-diméthyl-5-oxoheptanoyl]-5-isopropyl-2,4-diméthyl-α-L-ribopyranose [French] [ACD/IUPAC Name]
dolabriferol
α-L-Ribopyranose, 2,4-dideoxy-1-C-ethyl-3-O-[(2R,3R,4S)-3-hydroxy-2,4-dimethyl-1,5-dioxoheptyl]-2,4-dimethyl-5-C-(1-methylethyl)-, (5S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 503.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 89.0±6.0 kJ/mol
Flash Point: 163.7±23.6 °C
Index of Refraction: 1.487
Molar Refractivity: 103.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 52.33
ACD/KOC (pH 5.5): 591.38
ACD/LogD (pH 7.4): 2.56
ACD/BCF (pH 7.4): 52.33
ACD/KOC (pH 7.4): 591.38
Polar Surface Area: 93 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 39.8±5.0 dyne/cm
Molar Volume: 361.0±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement