ChemSpider 2D Image | 2-Methyl-2-propanyl 3-{benzyl[(1S)-1-phenylethyl]amino}-2,3-dideoxy-6-O-[dimethyl(2-methyl-2-propanyl)silyl]-4,5-O-isopropylidene-L-arabino-hexonate | C34H53NO5Si

2-Methyl-2-propanyl 3-{benzyl[(1S)-1-phenylethyl]amino}-2,3-dideoxy-6-O-[dimethyl(2-methyl-2-propanyl)silyl]-4,5-O-isopropylidene-L-arabino-hexonate

  • Molecular FormulaC34H53NO5Si
  • Average mass583.874 Da
  • Monoisotopic mass583.369324 Da
  • ChemSpider ID31107017

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

2-Methyl-2-propanyl 3-{benzyl[(1S)-1-phenylethyl]amino}-2,3-dideoxy-6-O-[dimethyl(2-methyl-2-propanyl)silyl]-4,5-O-isopropylidene-L-arabino-hexonate [ACD/IUPAC Name]
2-Methyl-2-propanyl-3-{benzyl[(1S)-1-phenylethyl]amino}-2,3-didesoxy-6-O-[dimethyl(2-methyl-2-propanyl)silyl]-4,5-O-isopropyliden-L-arabino-hexonat [German] [ACD/IUPAC Name]
3-{Benzyl[(1S)-1-phényléthyl]amino}-2,3-didésoxy-6-O-[diméthyl(2-méthyl-2-propanyl)silyl]-4,5-O-isopropylidène-L-arabino-hexonate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
L-arabino-Hexonic acid, 2,3-dideoxy-6-O-[(1,1-dimethylethyl)dimethylsilyl]-4,5-O-(1-methylethylidene)-3-[[(1S)-1-phenylethyl](phenylmethyl)amino]-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 594.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.6±3.0 kJ/mol
Flash Point: 313.5±30.1 °C
Index of Refraction: 1.506
Molar Refractivity: 170.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 9.73
ACD/LogD (pH 5.5): 7.77
ACD/BCF (pH 5.5): 362267.28
ACD/KOC (pH 5.5): 241916.02
ACD/LogD (pH 7.4): 8.24
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 715996.44
Polar Surface Area: 57 Å2
Polarizability: 67.4±0.5 10-24cm3
Surface Tension: 34.2±3.0 dyne/cm
Molar Volume: 572.1±3.0 cm3

Click to predict properties on the Chemicalize site


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