ChemSpider 2D Image | (S)-2-{(S)-2-[4-(Benzyloxy)phenyl]-2-[(3R,4R)-3,4-bis(triisopropylsilyloxy)-3,4-dihydro-2H-pyran-6-yl]ethyl}-4-isopropyl-4,5-dihydrooxazole | C44H71NO5Si2

(S)-2-{(S)-2-[4-(Benzyloxy)phenyl]-2-[(3R,4R)-3,4-bis(triisopropylsilyloxy)-3,4-dihydro-2H-pyran-6-yl]ethyl}-4-isopropyl-4,5-dihydrooxazole

  • Molecular FormulaC44H71NO5Si2
  • Average mass750.209 Da
  • Monoisotopic mass749.487061 Da
  • ChemSpider ID24776179

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(S)-2-{(S)-2-[4-(Benzyloxy)phenyl]-2-[(3R,4R)-3,4-bis(triisopropylsilyloxy)-3,4-dihydro-2H-pyran-6-yl]ethyl}-4-isopropyl-4,5-dihydrooxazole
1,5-Anhydro-1-{(1S)-1-[4-(benzyloxy)phenyl]-2-[(4S)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]ethyl}-2-deoxy-3,4-bis-O-(triisopropylsilyl)-D-threo-pent-1-enitol [ACD/IUPAC Name]
1,5-Anhydro-1-{(1S)-1-[4-(benzyloxy)phenyl]-2-[(4S)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]ethyl}-2-desoxy-3,4-bis-O-(triisopropylsilyl)-D-threo-pent-1-enitol [German] [ACD/IUPAC Name]
1,5-Anhydro-1-{(1S)-1-[4-(benzyloxy)phényl]-2-[(4S)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]éthyl}-2-désoxy-3,4-bis-O-(triisopropylsilyl)-D-thréo-pent-1-énitol [French] [ACD/IUPAC Name]
D-arabino-Hept-4-enitol, 1,5-anhydro-4,6,7-trideoxy-7-[(4S)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]-6-[4-(phenylmethoxy)phenyl]-2,3-bis-O-[tris(1-methylethyl)silyl]- [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: 709.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 382.8±32.9 °C
Index of Refraction: 1.518
Molar Refractivity: 220.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 12.26
ACD/LogD (pH 5.5): 10.89
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.15
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 59 Å2
Polarizability: 87.5±0.5 10-24cm3
Surface Tension: 29.1±7.0 dyne/cm
Molar Volume: 728.4±7.0 cm3

Click to predict properties on the Chemicalize site


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