Found 62 results

Search term: MF = 'C_{35}H_{52}O_{5}'
ChemSpider 2D Image | (1R,5S)-3-O-Acetyl-1,5-anhydro-1,5-bis[(3S)-5-(benzyloxy)-3-methylpentyl]-2,4-dideoxy-2,4-dimethyl-L-threo-pentitol | C35H52O5

(1R,5S)-3-O-Acetyl-1,5-anhydro-1,5-bis[(3S)-5-(benzyloxy)-3-methylpentyl]-2,4-dideoxy-2,4-dimethyl-L-threo-pentitol

  • Molecular FormulaC35H52O5
  • Average mass552.784 Da
  • Monoisotopic mass552.381470 Da
  • ChemSpider ID9716060

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(1R,5S)-3-O-Acetyl-1,5-anhydro-1,5-bis[(3S)-5-(benzyloxy)-3-methylpentyl]-2,4-dideoxy-2,4-dimethyl-L-threo-pentitol [ACD/IUPAC Name]
(1R,5S)-3-O-Acetyl-1,5-anhydro-1,5-bis[(3S)-5-(benzyloxy)-3-methylpentyl]-2,4-didesoxy-2,4-dimethyl-L-threo-pentitol [German] [ACD/IUPAC Name]
(1R,5S)-3-O-Acétyl-1,5-anhydro-1,5-bis[(3S)-5-(benzyloxy)-3-méthylpentyl]-2,4-didésoxy-2,4-diméthyl-L-thréo-pentitol [French] [ACD/IUPAC Name]
L-threo-Pentitol, 1,5-anhydro-2,4-dideoxy-2,4-dimethyl-1,5-bis-C-[(3S)-3-methyl-5-(phenylmethoxy)pentyl]-, acetate, (1R,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: 604.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 247.0±30.2 °C
Index of Refraction: 1.527
Molar Refractivity: 162.9±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 8.59
ACD/LogD (pH 5.5): 8.21
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 700859.75
ACD/LogD (pH 7.4): 8.21
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 700859.75
Polar Surface Area: 54 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 529.7±5.0 cm3

Click to predict properties on the Chemicalize site


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