Found 25 results

Search term: MF = 'C_{37}H_{68}O_{8}'
ChemSpider 2D Image | (5S)-3-[(2R)-7-{(2R,5S)-5-[(1S,4R,5R)-4,5-Dihydroxy-1-(methoxymethoxy)nonadecyl]tetrahydro-2-furanyl}-2-hydroxyheptyl]-5-methyl-2(5H)-furanone | C37H68O8

(5S)-3-[(2R)-7-{(2R,5S)-5-[(1S,4R,5R)-4,5-Dihydroxy-1-(methoxymethoxy)nonadecyl]tetrahydro-2-furanyl}-2-hydroxyheptyl]-5-methyl-2(5H)-furanone

  • Molecular FormulaC37H68O8
  • Average mass640.931 Da
  • Monoisotopic mass640.491394 Da
  • ChemSpider ID9390937

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(5S)-3-[(2R)-7-{(2R,5S)-5-[(1S,4R,5R)-4,5-Dihydroxy-1-(methoxymethoxy)nonadecyl]tetrahydro-2-furanyl}-2-hydroxyheptyl]-5-methyl-2(5H)-furanon [German] [ACD/IUPAC Name]
(5S)-3-[(2R)-7-{(2R,5S)-5-[(1S,4R,5R)-4,5-Dihydroxy-1-(methoxymethoxy)nonadecyl]tetrahydro-2-furanyl}-2-hydroxyheptyl]-5-methyl-2(5H)-furanone [ACD/IUPAC Name]
(5S)-3-[(2R)-7-{(2R,5S)-5-[(1S,4R,5R)-4,5-Dihydroxy-1-(méthoxyméthoxy)nonadécyl]tétrahydro-2-furanyl}-2-hydroxyheptyl]-5-méthyl-2(5H)-furanone [French] [ACD/IUPAC Name]
2(5H)-Furanone, 3-[(2R)-7-[(2R,5S)-5-[(1S,4R,5R)-4,5-dihydroxy-1-(methoxymethoxy)nonadecyl]tetrahydro-2-furanyl]-2-hydroxyheptyl]-5-methyl-, (5S)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 753.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 125.3±6.0 kJ/mol
Flash Point: 220.6±26.4 °C
Index of Refraction: 1.494
Molar Refractivity: 180.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 2
ACD/LogP: 6.66
ACD/LogD (pH 5.5): 7.90
ACD/BCF (pH 5.5): 592015.56
ACD/KOC (pH 5.5): 471418.47
ACD/LogD (pH 7.4): 7.90
ACD/BCF (pH 7.4): 592015.56
ACD/KOC (pH 7.4): 471418.47
Polar Surface Area: 115 Å2
Polarizability: 71.5±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 619.0±3.0 cm3

Click to predict properties on the Chemicalize site


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