ChemSpider 2D Image | thr-ala-asp | C11H19N3O7

thr-ala-asp

  • Molecular FormulaC11H19N3O7
  • Average mass305.284 Da
  • Monoisotopic mass305.122314 Da
  • ChemSpider ID29368063

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

Acide L-thréonyl-L-alanyl-L-aspartique [French] [ACD/IUPAC Name]
L-Aspartic acid, L-threonyl-L-alanyl- [ACD/Index Name]
L-Threonyl-L-alanyl-L-asparaginsäure [German] [ACD/IUPAC Name]
L-Threonyl-L-alanyl-L-aspartic acid [ACD/IUPAC Name]
thr-ala-asp
L-Thr-L-Ala-L-Asp
TAD
T-A-D

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

Density: 1.4±0.1 g/cm3
Boiling Point: 700.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 117.2±6.0 kJ/mol
Flash Point: 377.3±32.9 °C
Index of Refraction: 1.551
Molar Refractivity: 68.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -1.29
ACD/LogD (pH 5.5): -5.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 179 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 68.2±3.0 dyne/cm
Molar Volume: 213.9±3.0 cm3

Click to predict properties on the Chemicalize site


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