Chemical Properties of Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, propyl ester

InChI

InChI=1S/C15H20ClNO4/c1-3-9-21-15(19)6-4-5-14(18)17-12-10-11(16)7-8-13(12)20-2/h7-8,10H,3-6,9H2,1-2H3,(H,17,18)

InChI Key

PDLAIOBPEYGJHP-UHFFFAOYSA-N

Formula

C15H20ClNO4

SMILES

CCCOC(=O)CCCC(=O)Nc1cc(Cl)ccc1OC

Molecular Weight¹

313.78

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fH°_gas : 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ΔfH°gas	-735.75	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	44.32	kJ/mol	Joback Calculated Property
ΔvapH°	97.79	kJ/mol	Relay (1.0) Calculated Property
logPoct/wat	3.411		Crippen Calculated Property
McVol	235.550	ml/mol	McGowan Calculated Property
Inp	[2693.00; 2693.00]
Inp	2693.00		NIST
Inp	2693.00		NIST
Tboil	636.44	K	Relay (1.0) Calculated Property
Tfus	349.62	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[668.36; 731.34]	J/mol×K	[801.55; 1008.89]
Cp,gas	668.36	J/mol×K	801.55	Joback Calculated Property
Cp,gas	681.39	J/mol×K	836.11	Joback Calculated Property
Cp,gas	693.39	J/mol×K	870.66	Joback Calculated Property
Cp,gas	704.38	J/mol×K	905.22	Joback Calculated Property
Cp,gas	714.36	J/mol×K	939.78	Joback Calculated Property
Cp,gas	723.34	J/mol×K	974.33	Joback Calculated Property
Cp,gas	731.34	J/mol×K	1008.89	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, propyl ester.

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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