Chemical Properties of Sarcosylsarcosine, n-propoxycarbonyl-, isohexyl ester

InChI

InChI=1S/C16H30N2O5/c1-6-9-23-16(21)18(5)11-14(19)17(4)12-15(20)22-10-7-8-13(2)3/h13H,6-12H2,1-5H3

InChI Key

YQVFRHSPXXMXGK-UHFFFAOYSA-N

Formula

C16H30N2O5

SMILES

CCCOC(=O)N(C)CC(=O)N(C)CC(=O)OCCCC(C)C

Molecular Weight¹

330.42

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion 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_c : Critical Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, 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	[826.44; 907.59]	J/mol×K	[760.43; 941.45]
Cp,gas	826.44	J/mol×K	760.43	Joback Calculated Property
Cp,gas	842.43	J/mol×K	790.60	Joback Calculated Property
Cp,gas	857.41	J/mol×K	820.77	Joback Calculated Property
Cp,gas	871.39	J/mol×K	850.94	Joback Calculated Property
Cp,gas	884.40	J/mol×K	881.11	Joback Calculated Property
Cp,gas	896.46	J/mol×K	911.28	Joback Calculated Property
Cp,gas	907.59	J/mol×K	941.45	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosylsarcosine, n-propoxycarbonyl-, isohexyl 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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