ChemSpider 2D Image | 5-Methoxy-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-tryptophan | C17H22N2O5

5-Methoxy-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-tryptophan

  • Molecular FormulaC17H22N2O5
  • Average mass334.367 Da
  • Monoisotopic mass334.152863 Da
  • ChemSpider ID25072831
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

5-Methoxy-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-tryptophan [German] [ACD/IUPAC Name]
5-Methoxy-N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-tryptophan [ACD/IUPAC Name]
5-Méthoxy-N-{[(2-méthyl-2-propanyl)oxy]carbonyl}-L-tryptophane [French] [ACD/IUPAC Name]
L-Tryptophan, N-[(1,1-dimethylethoxy)carbonyl]-5-methoxy- [ACD/Index Name]
(2S)-2-[(TERT-BUTOXYCARBONYL)AMINO]-3-(5-METHOXY-1H-INDOL-3-YL)PROPANOIC ACID
(2S)-2-{[(TERT-BUTOXY)CARBONYL]AMINO}-3-(5-METHOXY-1H-INDOL-3-YL)PROPANOIC ACID
(2S)-3-(5-methoxy-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
(S)-2-((tert-butoxycarbonyl)amino)-3-(5-methoxy-1H-indol-3-yl)propanoic acid
(S)-2-(tert-butoxycarbonylamino)-3-(5-methoxy-1H-indol-3-yl)propanoic acid
[114903-30-9]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 564.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.2±3.0 kJ/mol
Flash Point: 294.9±30.1 °C
Index of Refraction: 1.590
Molar Refractivity: 89.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.80
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.12
ACD/LogD (pH 7.4): -0.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 101 Å2
Polarizability: 35.4±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 265.1±3.0 cm3

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