ChemSpider 2D Image | Vinyl N-[(benzyloxy)carbonyl]-beta-alanylleucylleucylleucinate | C31H48N4O7

Vinyl N-[(benzyloxy)carbonyl]-β-alanylleucylleucylleucinate

  • Molecular FormulaC31H48N4O7
  • Average mass588.735 Da
  • Monoisotopic mass588.352295 Da
  • ChemSpider ID24625706

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

Leucine, N-[(phenylmethoxy)carbonyl]-β-alanylleucylleucyl-, ethenyl ester [ACD/Index Name]
N-[(Benzyloxy)carbonyl]-β-alanylleucylleucylleucinate de vinyle [French] [ACD/IUPAC Name]
Vinyl N-[(benzyloxy)carbonyl]-β-alanylleucylleucylleucinate [ACD/IUPAC Name]
VinylN-[(benzyloxy)carbonyl]-β-alanylleucylleucylleucinat [German] [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: 810.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.8±3.0 kJ/mol
Flash Point: 444.1±34.3 °C
Index of Refraction: 1.512
Molar Refractivity: 159.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 3
ACD/LogP: 5.89
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 418.82
ACD/KOC (pH 5.5): 2620.90
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 418.80
ACD/KOC (pH 7.4): 2620.80
Polar Surface Area: 152 Å2
Polarizability: 63.4±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 532.8±3.0 cm3

Click to predict properties on the Chemicalize site


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