ChemSpider 2D Image | 1-[6-Amino-2-(threonylamino)-4-hexynoyl]proline | C15H24N4O5

1-[6-Amino-2-(threonylamino)-4-hexynoyl]proline

  • Molecular FormulaC15H24N4O5
  • Average mass340.375 Da
  • Monoisotopic mass340.174683 Da
  • ChemSpider ID28563297

More details:

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

1-[6-Amino-2-(threonylamino)-4-hexynoyl]prolin [German] [ACD/IUPAC Name]
1-[6-Amino-2-(threonylamino)-4-hexynoyl]proline [ACD/IUPAC Name]
1-[6-Amino-2-(thréonylamino)-4-hexynoyl]proline [French] [ACD/IUPAC Name]
Proline, 1-[6-amino-2-[(2-amino-3-hydroxy-1-oxobutyl)amino]-1-oxo-4-hexyn-1-yl]- [ACD/Index Name]
1-[(2R)-6-AMINO-2-(L-THREONYLAMINO)HEX-4-YNOYL]-L-PROLINE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 733.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 122.1±6.0 kJ/mol
Flash Point: 397.1±32.9 °C
Index of Refraction: 1.590
Molar Refractivity: 84.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -1.55
ACD/LogD (pH 5.5): -5.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 159 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 73.7±3.0 dyne/cm
Molar Volume: 250.6±3.0 cm3

Click to predict properties on the Chemicalize site


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