ChemSpider 2D Image | N-[(Benzyloxy)carbonyl]-L-isoleucyl-D-alloisoleucine | C20H30N2O5

N-[(Benzyloxy)carbonyl]-L-isoleucyl-D-alloisoleucine

  • Molecular FormulaC20H30N2O5
  • Average mass378.463 Da
  • Monoisotopic mass378.215485 Da
  • ChemSpider ID60958843

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

D-Alloisoleucine, N-[(phenylmethoxy)carbonyl]-L-isoleucyl- [ACD/Index Name]
N-[(Benzyloxy)carbonyl]-L-isoleucyl-D-alloisoleucin [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-isoleucyl-D-alloisoleucine [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-L-isoleucyl-D-alloisoleucine [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 598.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 315.5±28.7 °C
Index of Refraction: 1.520
Molar Refractivity: 101.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.06
ACD/LogD (pH 5.5): 0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.00
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 105 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 43.3±3.0 dyne/cm
Molar Volume: 334.7±3.0 cm3

Click to predict properties on the Chemicalize site


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