ChemSpider 2D Image | N-(4-Aminobutanoyl)-D-histidine | C10H16N4O3

N-(4-Aminobutanoyl)-D-histidine

  • Molecular FormulaC10H16N4O3
  • Average mass240.259 Da
  • Monoisotopic mass240.122238 Da
  • ChemSpider ID49745504

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Histidine, N-(4-amino-1-oxobutyl)- [ACD/Index Name]
N-(4-Aminobutanoyl)-D-histidin [German] [ACD/IUPAC Name]
N-(4-Aminobutanoyl)-D-histidine [ACD/IUPAC Name]
N-(4-Aminobutanoyl)-D-histidine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 646.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 345.1±31.5 °C
Index of Refraction: 1.579
Molar Refractivity: 60.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -1.96
ACD/LogD (pH 5.5): -4.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 67.0±3.0 dyne/cm
Molar Volume: 180.9±3.0 cm3

Click to predict properties on the Chemicalize site


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