Found 8 results

Search term: MF = 'C_{41}H_{52}O_{10}'
ChemSpider 2D Image | Methyl (6R)-2,6-anhydro-4,5-di-O-benzyl-6-[(benzyloxy)methyl]-2-{(2S)-1,4-bis[(2-methyl-2-propanyl)oxy]-1,4-dioxo-2-butanyl}-3-deoxy-D-xylo-hexonate | C41H52O10

Methyl (6R)-2,6-anhydro-4,5-di-O-benzyl-6-[(benzyloxy)methyl]-2-{(2S)-1,4-bis[(2-methyl-2-propanyl)oxy]-1,4-dioxo-2-butanyl}-3-deoxy-D-xylo-hexonate

  • Molecular FormulaC41H52O10
  • Average mass704.846 Da
  • Monoisotopic mass704.356018 Da
  • ChemSpider ID9017766

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(6R)-2,6-Anhydro-4,5-di-O-benzyl-6-[(benzyloxy)méthyl]-2-{(2S)-1,4-bis[(2-méthyl-2-propanyl)oxy]-1,4-dioxo-2-butanyl}-3-désoxy-D-xylo-hexonate de méthyle [French] [ACD/IUPAC Name]
D-glycero-D-galacto-Nononic acid, 4,8-anhydro-2,3,5-trideoxy-3-[(1,1-dimethylethoxy)carbonyl]-4-C-(methoxycarbonyl)-6,7,9-tris-O-(phenylmethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]
Methyl (6R)-2,6-anhydro-4,5-di-O-benzyl-6-[(benzyloxy)methyl]-2-{(2S)-1,4-bis[(2-methyl-2-propanyl)oxy]-1,4-dioxo-2-butanyl}-3-deoxy-D-xylo-hexonate [ACD/IUPAC Name]
Methyl-(6R)-2,6-anhydro-4,5-di-O-benzyl-6-[(benzyloxy)methyl]-2-{(2S)-1,4-bis[(2-methyl-2-propanyl)oxy]-1,4-dioxo-2-butanyl}-3-desoxy-D-xylo-hexonat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 722.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.6±3.0 kJ/mol
Flash Point: 289.2±32.9 °C
Index of Refraction: 1.559
Molar Refractivity: 193.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 3
ACD/LogP: 10.96
ACD/LogD (pH 5.5): 9.28
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2656750.25
ACD/LogD (pH 7.4): 9.28
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2656750.25
Polar Surface Area: 116 Å2
Polarizability: 76.6±0.5 10-24cm3
Surface Tension: 48.9±5.0 dyne/cm
Molar Volume: 598.2±5.0 cm3

Click to predict properties on the Chemicalize site


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