ChemSpider 2D Image | N~6~-[(Allyloxy)carbonyl]-N~2~-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]-L-lysine | C20H30N2O6

N6-[(Allyloxy)carbonyl]-N2-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]-L-lysine

  • Molecular FormulaC20H30N2O6
  • Average mass394.462 Da
  • Monoisotopic mass394.210388 Da
  • ChemSpider ID34998288

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Lysine, N2-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]-N6-[(2-propen-1-yloxy)carbonyl]- [ACD/Index Name]
N6-[(Allyloxy)carbonyl]-N2-[1-(4,4-dimethyl-2,6-dioxocyclohexyliden)ethyl]-L-lysin [German] [ACD/IUPAC Name]
N6-[(Allyloxy)carbonyl]-N2-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]-L-lysine [ACD/IUPAC Name]
N6-[(Allyloxy)carbonyl]-N2-[1-(4,4-diméthyl-2,6-dioxocyclohexylidène)éthyl]-L-lysine [French] [ACD/IUPAC Name]
264230-73-1 [RN]
Dde-L-Lys(Aloc)-OH*DCHA
DDE-LYS(ALLOC)-OH
N-α-(4-4-Dimethyl-2,6-dioxocyclohex-1-ylidene)ethyl-N-ε-allyloxycarbonyl-L-lysine dicyclohexylamine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 592.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 96.5±6.0 kJ/mol
Flash Point: 312.0±30.1 °C
Index of Refraction: 1.517
Molar Refractivity: 102.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 1.01
ACD/KOC (pH 5.5): 15.16
ACD/LogD (pH 7.4): -1.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 45.1±3.0 dyne/cm
Molar Volume: 339.5±3.0 cm3

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