ChemSpider 2D Image | (2S)-2-({(2S,3S)-1-[(4-Methoxybenzyl)oxy]-3-[(triisopropylsilyl)oxy]-5-hexen-2-yl}oxy)-N,N-dimethylbutanamide | C29H51NO5Si

(2S)-2-({(2S,3S)-1-[(4-Methoxybenzyl)oxy]-3-[(triisopropylsilyl)oxy]-5-hexen-2-yl}oxy)-N,N-dimethylbutanamide

  • Molecular FormulaC29H51NO5Si
  • Average mass521.804 Da
  • Monoisotopic mass521.353638 Da
  • ChemSpider ID74172693

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S)-2-({(2S,3S)-1-[(4-Methoxybenzyl)oxy]-3-[(triisopropylsilyl)oxy]-5-hexen-2-yl}oxy)-N,N-dimethylbutanamid [German] [ACD/IUPAC Name]
(2S)-2-({(2S,3S)-1-[(4-Methoxybenzyl)oxy]-3-[(triisopropylsilyl)oxy]-5-hexen-2-yl}oxy)-N,N-dimethylbutanamide [ACD/IUPAC Name]
(2S)-2-({(2S,3S)-1-[(4-Méthoxybenzyl)oxy]-3-[(triisopropylsilyl)oxy]-5-hexén-2-yl}oxy)-N,N-diméthylbutanamide [French] [ACD/IUPAC Name]
Butanamide, 2-[[(1S,2S)-1-[[(4-methoxyphenyl)methoxy]methyl]-2-[[tris(1-methylethyl)silyl]oxy]-4-penten-1-yl]oxy]-N,N-dimethyl-, (2S)- [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: 561.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.4±3.0 kJ/mol
Flash Point: 293.3±30.1 °C
Index of Refraction: 1.483
Molar Refractivity: 152.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 8.17
ACD/LogD (pH 5.5): 7.02
ACD/BCF (pH 5.5): 126970.70
ACD/KOC (pH 5.5): 156606.03
ACD/LogD (pH 7.4): 7.02
ACD/BCF (pH 7.4): 126970.70
ACD/KOC (pH 7.4): 156606.03
Polar Surface Area: 57 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 31.1±3.0 dyne/cm
Molar Volume: 532.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement