ChemSpider 2D Image | (2R)-5-(Benzyloxy)-2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-5-oxopentanoic acid (non-preferred name) | C18H25NO6

(2R)-5-(Benzyloxy)-2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-5-oxopentanoic acid (non-preferred name)

  • Molecular FormulaC18H25NO6
  • Average mass351.394 Da
  • Monoisotopic mass351.168182 Da
  • ChemSpider ID29312308

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-5-(Benzyloxy)-2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-5-oxopentanoic acid (non-preferred name) [ACD/IUPAC Name]
(2R)-5-(Benzyloxy)-2-(methyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-5-oxopentansäure [German] [ACD/IUPAC Name]
Acide (2R)-5-(benzyloxy)-2-(méthyl{[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-5-oxopentanoïque [French] [ACD/IUPAC Name]
D-Glutamic acid, N-[(1,1-dimethylethoxy)carbonyl]-N-methyl-, 5-(phenylmethyl) ester [ACD/Index Name]
(2R)-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-oxo-5-phenylmethoxypentanoic acid
(R)-5-(benzyloxy)-2-((tert-butoxycarbonyl)(methyl)amino)-5-oxopentanoic acid
1562452-07-6 [RN]
Boc-N-Me-D-Glu(OBzl)-OH
Boc-Nα-methyl-D-glutamic acid γ-benzyl ester
Boc-Nα-methyl-D-glutamic acid γ-benzylester
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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: 501.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 256.8±30.1 °C
Index of Refraction: 1.525
Molar Refractivity: 90.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 1.24
ACD/BCF (pH 5.5): 1.63
ACD/KOC (pH 5.5): 12.70
ACD/LogD (pH 7.4): -0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 93 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 296.6±3.0 cm3

Click to predict properties on the Chemicalize site


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