ChemSpider 2D Image | Methyl 5-methoxy-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tryptophanate | C18H24N2O5

Methyl 5-methoxy-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tryptophanate

  • Molecular FormulaC18H24N2O5
  • Average mass348.394 Da
  • Monoisotopic mass348.168518 Da
  • ChemSpider ID28553060

More details:

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

5-Méthoxy-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}tryptophanate de méthyle [French] [ACD/IUPAC Name]
Methyl 5-methoxy-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tryptophanate [ACD/IUPAC Name]
Methyl-5-methoxy-N-{[(2-methyl-2-propanyl)oxy]carbonyl}tryptophanat [German] [ACD/IUPAC Name]
Tryptophan, N-[(1,1-dimethylethoxy)carbonyl]-5-methoxy-, methyl ester [ACD/Index Name]
(3S,11bS)-3-Isobutyl-9,10-dimethoxy-3,4,6,7-tetrahydro-1H-pyrido[2,1-a]isoquinolin-2(11bH)-one
394-25-2 [RN]
Methyl (S)-2-(N-Boc-Amino)-3-(5-methoxyindol-3-yl)propionate
MFCD11656820 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 535.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.6±30.1 °C
Index of Refraction: 1.562
Molar Refractivity: 94.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.22
ACD/LogD (pH 5.5): 3.10
ACD/BCF (pH 5.5): 132.84
ACD/KOC (pH 5.5): 1152.10
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 132.81
ACD/KOC (pH 7.4): 1151.83
Polar Surface Area: 90 Å2
Polarizability: 37.4±0.5 10-24cm3
Surface Tension: 45.0±3.0 dyne/cm
Molar Volume: 290.4±3.0 cm3

Click to predict properties on the Chemicalize site


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