Chemical Properties of N-(2-Hydroxyethyl)iminodiacetic acid (CAS 93-62-9)

InChI

InChI=1S/C6H11NO5/c8-2-1-7(3-5(9)10)4-6(11)12/h8H,1-4H2,(H,9,10)(H,11,12)

InChI Key

JYXGIOKAKDAARW-UHFFFAOYSA-N

Formula

C6H11NO5

SMILES

O=C(O)CN(CCO)CC(=O)O

Molecular Weight¹

177.16

CAS

93-62-9

Other Names

• Glycine, N-(carboxymethyl)-N-(2-hydroxyethyl)-
• Acetic acid, [(2-hydroxyethyl)imino]di-
• (Hydroxyethylimino)diacetic acid
• (2-Hydroxyethyl)iminodiacetic acid
• [(«beta»-Hydroxyethyl)imino]diacetic acid
• Acetic acid, (hydroxyethyl)iminodi-
• Ethanolamine-N,N-diacetic acid
• Hydroxyethylnitrilodiacetic acid
• HEIDA
• N-(«beta»-Hydroxyethyl)Iminodiacetic acid
• N-(2-Hydroxyethyl)imidodiacetic acid
• N-Hydroxyethyliminodiacetic acid
• 2-Hydroxyethylaminodiacetic acid
• USAF DO-37
• NSC 18474

• Δ_cH°_solid : Standard solid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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	[188.02; 407.13]	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			1.23400e+00
Coefficient B			8.33300e-01
Coefficient C			-5.90800e-04
Coefficient D			1.63400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	188.02	J/mol×K	273.00	Calculated Property
Cp,gas	229.33	J/mol×K	353.78	Calculated Property
Cp,gas	265.19	J/mol×K	434.56	Calculated Property
Cp,gas	296.13	J/mol×K	515.33	Calculated Property
Cp,gas	322.65	J/mol×K	596.11	Calculated Property
Cp,gas	345.27	J/mol×K	676.89	Calculated Property
Cp,gas	364.51	J/mol×K	757.67	Calculated Property
Cp,gas	380.89	J/mol×K	838.44	Calculated Property
Cp,gas	394.93	J/mol×K	919.22	Calculated Property
Cp,gas	407.13	J/mol×K	1000.00	Calculated Property

Similar Compounds

Find more compounds similar to N-(2-Hydroxyethyl)iminodiacetic acid.

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.
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