ChemSpider 2D Image | O-Acetyl-N-(2-bromobenzoyl)tyrosyl-N-cyclohexyl-L-prolinamide | C29H34BrN3O5

O-Acetyl-N-(2-bromobenzoyl)tyrosyl-N-cyclohexyl-L-prolinamide

  • Molecular FormulaC29H34BrN3O5
  • Average mass584.501 Da
  • Monoisotopic mass583.168152 Da
  • ChemSpider ID122887768

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

L-Prolinamide, O-acetyl-N-(2-bromobenzoyl)tyrosyl-N-cyclohexyl- [ACD/Index Name]
O-Acetyl-N-(2-brombenzoyl)tyrosyl-N-cyclohexyl-L-prolinamid [German] [ACD/IUPAC Name]
O-Acetyl-N-(2-bromobenzoyl)tyrosyl-N-cyclohexyl-L-prolinamide [ACD/IUPAC Name]
O-Acétyl-N-(2-bromobenzoyl)tyrosyl-N-cyclohexyl-L-prolinamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 810.6±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: 444.0±34.3 °C
Index of Refraction: 1.622
Molar Refractivity: 147.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.66
ACD/LogD (pH 5.5): 4.00
ACD/BCF (pH 5.5): 647.07
ACD/KOC (pH 5.5): 3578.34
ACD/LogD (pH 7.4): 4.00
ACD/BCF (pH 7.4): 647.07
ACD/KOC (pH 7.4): 3578.31
Polar Surface Area: 105 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 60.8±5.0 dyne/cm
Molar Volume: 417.7±5.0 cm3

Click to predict properties on the Chemicalize site


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