ChemSpider 2D Image | BOC-ALA-D-GLU(OBZL)-NH2 | C20H29N3O6

BOC-ALA-D-GLU(OBZL)-NH2

  • Molecular FormulaC20H29N3O6
  • Average mass407.461 Da
  • Monoisotopic mass407.205627 Da
  • ChemSpider ID35303401

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

18814-49-8 [RN]
Benzyl N-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-alanylglutaminate [ACD/IUPAC Name]
BenzylN-{[(2-methyl-2-propanyl)oxy]carbonyl}-L-alanylglutaminat [German] [ACD/IUPAC Name]
BOC-ALA-D-GLU(OBZL)-NH2
Glutamine, N-[(1,1-dimethylethoxy)carbonyl]-L-alanyl-, phenylmethyl ester [ACD/Index Name]
N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-L-alanylglutaminate de benzyle [French] [ACD/IUPAC Name]
(R)-Benzyl 5-amino-2-((S)-2-((tert-butoxycarbonyl)amino)propanamido)-5-oxopentanoate
benzyl (2R)-2-[(2S)-2-[(tert-butoxycarbonyl)amino]propanamido]-4-carbamoylbutanoate
benzyl (2R)-2-[(2S)-2-{[(tert-butoxy)carbonyl]amino}propanamido]-4-carbamoylbutanoate
D-a-Glutamine,N-[(1,1-dimethylethoxy)carbonyl]-L-alanyl-, phenylmethyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 659.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.1±3.0 kJ/mol
Flash Point: 352.8±31.5 °C
Index of Refraction: 1.527
Molar Refractivity: 105.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 9.90
ACD/KOC (pH 5.5): 179.64
ACD/LogD (pH 7.4): 1.61
ACD/BCF (pH 7.4): 9.90
ACD/KOC (pH 7.4): 179.60
Polar Surface Area: 137 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 343.6±3.0 cm3

Click to predict properties on the Chemicalize site


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