ChemSpider 2D Image | 5-Oxoprolylhistidyl-N-(4-carboxybutyl)prolinamide | C21H30N6O6

5-Oxoprolylhistidyl-N-(4-carboxybutyl)prolinamide

  • Molecular FormulaC21H30N6O6
  • Average mass462.500 Da
  • Monoisotopic mass462.222687 Da
  • ChemSpider ID28708814

More details:

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

5-Oxoprolylhistidyl-N-(4-carboxybutyl)prolinamid [German] [ACD/IUPAC Name]
5-Oxoprolylhistidyl-N-(4-carboxybutyl)prolinamide [ACD/IUPAC Name]
5-Oxoprolylhistidyl-N-(4-carboxybutyl)prolinamide [French] [ACD/IUPAC Name]
Prolinamide, 5-oxoprolylhistidyl-N-(4-carboxybutyl)- [ACD/Index Name]
5-({1-[3-(3H-IMIDAZOL-4-YL)-2-[(5-OXOPYRROLIDIN-2-YL)FORMAMIDO]PROPANOYL]PYRROLIDIN-2-YL}FORMAMIDO)PENTANOIC ACID

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1041.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 159.6±3.0 kJ/mol
Flash Point: 583.6±34.3 °C
Index of Refraction: 1.590
Molar Refractivity: 113.8±0.3 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: -2.51
ACD/LogD (pH 5.5): -3.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 174 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 68.7±3.0 dyne/cm
Molar Volume: 337.1±3.0 cm3

Click to predict properties on the Chemicalize site


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