ChemSpider 2D Image | N-[(2Z)-1-(Methylamino)-1-oxo-2-buten-2-yl]-Nalpha-{[(2-methyl-2-propanyl)oxy]carbonyl}phenylalaninamide | C19H27N3O4

N-[(2Z)-1-(Methylamino)-1-oxo-2-buten-2-yl]-Nα-{[(2-methyl-2-propanyl)oxy]carbonyl}phenylalaninamide

  • Molecular FormulaC19H27N3O4
  • Average mass361.435 Da
  • Monoisotopic mass361.200165 Da
  • ChemSpider ID68022859

  • Double-bond stereo - Double-bond stereo

More details:

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

Carbamic acid, N-[2-[[(1Z)-1-[(methylamino)carbonyl]-1-propen-1-yl]amino]-2-oxo-1-(phenylmethyl)ethyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-[(2Z)-1-(Methylamino)-1-oxo-2-buten-2-yl]-Nα-{[(2-methyl-2-propanyl)oxy]carbonyl}phenylalaninamid [German] [ACD/IUPAC Name]
N-[(2Z)-1-(Methylamino)-1-oxo-2-buten-2-yl]-Nα-{[(2-methyl-2-propanyl)oxy]carbonyl}phenylalaninamide [ACD/IUPAC Name]
N-[(2Z)-1-(Méthylamino)-1-oxo-2-butén-2-yl]-Nα-{[(2-méthyl-2-propanyl)oxy]carbonyl}phénylalaninamide [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: 643.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.0±3.0 kJ/mol
Flash Point: 343.0±31.5 °C
Index of Refraction: 1.529
Molar Refractivity: 99.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 20.32
ACD/KOC (pH 5.5): 300.51
ACD/LogD (pH 7.4): 2.02
ACD/BCF (pH 7.4): 20.31
ACD/KOC (pH 7.4): 300.40
Polar Surface Area: 97 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 321.8±3.0 cm3

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