ChemSpider 2D Image | N~2~-[(Benzyloxy)carbonyl]-N~6~-[(2-oxo-2H-chromen-3-yl)carbonyl]-L-lysyl-L-aspartic acid | C28H29N3O10

N2-[(Benzyloxy)carbonyl]-N6-[(2-oxo-2H-chromen-3-yl)carbonyl]-L-lysyl-L-aspartic acid

  • Molecular FormulaC28H29N3O10
  • Average mass567.544 Da
  • Monoisotopic mass567.185303 Da
  • ChemSpider ID21426463

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Acide N2-[(benzyloxy)carbonyl]-N6-[(2-oxo-2H-chromén-3-yl)carbonyl]-L-lysyl-L-aspartique [French] [ACD/IUPAC Name]
L-Aspartic acid, N6-[(2-oxo-2H-1-benzopyran-3-yl)carbonyl]-N2-[(phenylmethoxy)carbonyl]-L-lysyl- [ACD/Index Name]
N2-[(Benzyloxy)carbonyl]-N6-[(2-oxo-2H-chromen-3-yl)carbonyl]-L-lysyl-L-asparaginsäure [German] [ACD/IUPAC Name]
N2-[(Benzyloxy)carbonyl]-N6-[(2-oxo-2H-chromen-3-yl)carbonyl]-L-lysyl-L-aspartic acid [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 929.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 141.6±3.0 kJ/mol
Flash Point: 515.8±34.3 °C
Index of Refraction: 1.607
Molar Refractivity: 140.1±0.3 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 2.21
ACD/LogD (pH 5.5): -2.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 197 Å2
Polarizability: 55.5±0.5 10-24cm3
Surface Tension: 66.3±3.0 dyne/cm
Molar Volume: 405.7±3.0 cm3

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