ChemSpider 2D Image | Benzyl {(1S,3S)-3-[4-methoxy-3-(3-methoxypropoxy)benzyl]-4-methyl-1-[(2S)-5-oxotetrahydro-2-furanyl]pentyl}carbamate | C30H41NO7

Benzyl {(1S,3S)-3-[4-methoxy-3-(3-methoxypropoxy)benzyl]-4-methyl-1-[(2S)-5-oxotetrahydro-2-furanyl]pentyl}carbamate

  • Molecular FormulaC30H41NO7
  • Average mass527.649 Da
  • Monoisotopic mass527.288330 Da
  • ChemSpider ID9766566

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

{(1S,3S)-3-[4-Méthoxy-3-(3-méthoxypropoxy)benzyl]-4-méthyl-1-[(2S)-5-oxotétrahydro-2-furanyl]pentyl}carbamate de benzyle [French] [ACD/IUPAC Name]
Benzyl {(1S,3S)-3-[4-methoxy-3-(3-methoxypropoxy)benzyl]-4-methyl-1-[(2S)-5-oxotetrahydro-2-furanyl]pentyl}carbamate [ACD/IUPAC Name]
Benzyl-{(1S,3S)-3-[4-methoxy-3-(3-methoxypropoxy)benzyl]-4-methyl-1-[(2S)-5-oxotetrahydro-2-furanyl]pentyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(1S,3S)-3-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-4-methyl-1-[(2S)-tetrahydro-5-oxo-2-furanyl]pentyl]-, phenylmethyl ester [ACD/Index Name]
[(1S,3S)-3-[[4-Methoxy-3-(3-methoxypropoxy)phenyl]methyl]-4-methyl-1-[(2S)-tetrahydro-5-oxo-2-furany
[(1S,3S)-3-[[4-Methoxy-3-(3-methoxypropoxy)phenyl]methyl]-4-methyl-1-[(2S)-tetrahydro-5-oxo-2-furanyl]pentyl]carbamic Acid Benzyl Ester
900811-45-2 [RN]
benzyl N-[(1S,3S)-3-[[4-methoxy-3-(3-methoxypropoxy)phenyl]methyl]-4-methyl-1-[(2S)-5-oxooxolan-2-yl]pentyl]carbamate
FT-0671255

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

Density: 1.1±0.1 g/cm3
Boiling Point: 689.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 371.1±31.5 °C
Index of Refraction: 1.535
Molar Refractivity: 145.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 4.54
ACD/LogD (pH 5.5): 4.83
ACD/BCF (pH 5.5): 2751.46
ACD/KOC (pH 5.5): 10084.05
ACD/LogD (pH 7.4): 4.83
ACD/BCF (pH 7.4): 2751.29
ACD/KOC (pH 7.4): 10083.43
Polar Surface Area: 92 Å2
Polarizability: 57.5±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 465.7±3.0 cm3

Click to predict properties on the Chemicalize site


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