Found 132 results

Search term: MF = 'C_{36}H_{35}NO_{5}'
ChemSpider 2D Image | O-(2-{4-[(E)-2-(4-Methylphenyl)vinyl]phenoxy}ethyl)-N-[(2E)-4-oxo-4-phenyl-2-buten-2-yl]tyrosine | C36H35NO5

O-(2-{4-[(E)-2-(4-Methylphenyl)vinyl]phenoxy}ethyl)-N-[(2E)-4-oxo-4-phenyl-2-buten-2-yl]tyrosine

  • Molecular FormulaC36H35NO5
  • Average mass561.667 Da
  • Monoisotopic mass561.251526 Da
  • ChemSpider ID58128584

  • Double-bond stereo - Double-bond stereo

More details:

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

O-(2-{4-[(E)-2-(4-Methylphenyl)vinyl]phenoxy}ethyl)-N-[(2E)-4-oxo-4-phenyl-2-buten-2-yl]tyrosin [German] [ACD/IUPAC Name]
O-(2-{4-[(E)-2-(4-Methylphenyl)vinyl]phenoxy}ethyl)-N-[(2E)-4-oxo-4-phenyl-2-buten-2-yl]tyrosine [ACD/IUPAC Name]
O-(2-{4-[(E)-2-(4-Méthylphényl)vinyl]phénoxy}éthyl)-N-[(2E)-4-oxo-4-phényl-2-butén-2-yl]tyrosine [French] [ACD/IUPAC Name]
Tyrosine, N-[(1E)-1-methyl-3-oxo-3-phenyl-1-propen-1-yl]-O-[2-[4-[(E)-2-(4-methylphenyl)ethenyl]phenoxy]ethyl]- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL3355863/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 763.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.7±3.0 kJ/mol
Flash Point: 415.7±32.9 °C
Index of Refraction: 1.637
Molar Refractivity: 168.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 8.97
ACD/LogD (pH 5.5): 5.80
ACD/BCF (pH 5.5): 6456.98
ACD/KOC (pH 5.5): 6798.89
ACD/LogD (pH 7.4): 4.46
ACD/BCF (pH 7.4): 297.27
ACD/KOC (pH 7.4): 313.01
Polar Surface Area: 85 Å2
Polarizability: 66.9±0.5 10-24cm3
Surface Tension: 50.9±3.0 dyne/cm
Molar Volume: 469.8±3.0 cm3

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