Chemical Properties of gly-gly-ala

InChI

InChI=1S/C7H13N3O4/c1-4(7(13)14)10-6(12)3-9-5(11)2-8/h4H,2-3,8H2,1H3,(H,9,11)(H,10,12)(H,13,14)

InChI Key

CCQOOWAONKGYKQ-UHFFFAOYSA-N

Formula

C7H13N3O4

SMILES

CC(NC(=O)CNC(=O)CN)C(=O)O

Molecular Weight¹

203.20

• BasG : Gas basicity (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[221.88; 479.57]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.82320e+01
Coefficient B			8.83820e-01
Coefficient C			-5.36000e-04
Coefficient D			1.13520e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	221.88	J/mol×K	273.00	Calculated Property
Cp,gas	268.85	J/mol×K	353.78	Calculated Property
Cp,gas	310.40	J/mol×K	434.56	Calculated Property
Cp,gas	346.89	J/mol×K	515.33	Calculated Property
Cp,gas	378.67	J/mol×K	596.11	Calculated Property
Cp,gas	406.10	J/mol×K	676.89	Calculated Property
Cp,gas	429.55	J/mol×K	757.67	Calculated Property
Cp,gas	449.37	J/mol×K	838.44	Calculated Property
Cp,gas	465.93	J/mol×K	919.22	Calculated Property
Cp,gas	479.57	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to gly-gly-ala.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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