Found 20 results

Search term: C25H42O9 (Found by molecular formula)
ChemSpider 2D Image | (1R,4aR,6S,8R)-6-Hydroxy-3,8-bis(hydroxymethyl)-4-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-4a,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalenyl alpha-D-arabinopyranoside | C25H42O9

(1R,4aR,6S,8R)-6-Hydroxy-3,8-bis(hydroxymethyl)-4-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-4a,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalenyl α-D-arabinopyranoside

  • Molecular FormulaC25H42O9
  • Average mass486.596 Da
  • Monoisotopic mass486.282898 Da
  • ChemSpider ID113589368

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 9 defined stereocentres

More details:

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

(1R,4aR,6S,8R)-6-Hydroxy-3,8-bis(hydroxymethyl)-4-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-4a,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalenyl α-D-arabinopyranoside [ACD/IUPAC Name]
(1R,4aR,6S,8R)-6-Hydroxy-3,8-bis(hydroxymethyl)-4-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-4a,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphthalinyl-α-D-arabinopyranosid [German] [ACD/IUPAC Name]
α-D-Arabinopyranoside de (1R,4aR,6S,8R)-6-hydroxy-3,8-bis(hydroxyméthyl)-4-[(3E)-5-hydroxy-3-méthyl-3-pentén-1-yl]-4a,8-diméthyl-1,2,4a,5,6,7,8,8a-octahydro-1-naphtalényle [French] [ACD/IUPAC Name]
α-D-Arabinopyranoside, (1R,4aR,6S,8R)-1,2,4a,5,6,7,8,8a-octahydro-6-hydroxy-3,8-bis(hydroxymethyl)-4-[(3E)-5-hydroxy-3-methyl-3-penten-1-yl]-4a,8-dimethyl-1-naphthalenyl [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 695.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 116.5±6.0 kJ/mol
Flash Point: 374.5±31.5 °C
Index of Refraction: 1.597
Molar Refractivity: 124.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.58
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 3.52
ACD/KOC (pH 5.5): 85.61
ACD/LogD (pH 7.4): 1.02
ACD/BCF (pH 7.4): 3.52
ACD/KOC (pH 7.4): 85.61
Polar Surface Area: 160 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 66.1±5.0 dyne/cm
Molar Volume: 366.6±5.0 cm3

Click to predict properties on the Chemicalize site


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