ChemSpider 2D Image | Glycylglycylglycyl-L-alanyl-L-alanine | C12H21N5O6

Glycylglycylglycyl-L-alanyl-L-alanine

  • Molecular FormulaC12H21N5O6
  • Average mass331.325 Da
  • Monoisotopic mass331.149170 Da
  • ChemSpider ID58808578

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Glycylglycylglycyl-L-alanyl-L-alanin [German] [ACD/IUPAC Name]
Glycylglycylglycyl-L-alanyl-L-alanine [ACD/IUPAC Name]
Glycylglycylglycyl-L-alanyl-L-alanine [French] [ACD/IUPAC Name]
L-Alanine, glycylglycylglycyl-L-alanyl- [ACD/Index Name]
(2S,5S)-14-Amino-2,5-dimethyl-4,7,10,13-tetraoxo-3,6,9,12-tetraazatetradecan-1-oic acid
139964-63-9 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 876.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 138.3±6.0 kJ/mol
Flash Point: 484.1±34.3 °C
Index of Refraction: 1.531
Molar Refractivity: 77.2±0.3 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -2.58
ACD/LogD (pH 5.5): -4.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 180 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 57.6±3.0 dyne/cm
Molar Volume: 249.4±3.0 cm3

Click to predict properties on the Chemicalize site


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