Chemical Properties of L-Norvaline, N-propoxycarbonyl-, nonyl ester

InChI

InChI=1S/C18H35NO4/c1-4-7-8-9-10-11-12-15-22-17(20)16(13-5-2)19-18(21)23-14-6-3/h16H,4-15H2,1-3H3,(H,19,21)

InChI Key

KIGOGYGOAMKMEC-UHFFFAOYSA-N

Formula

C18H35NO4

SMILES

CCCCCCCCCOC(=O)C(CCC)NC(=O)OCCC

Molecular Weight¹

329.48

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	52.69	kJ/mol	Joback Calculated Property
ΔvapH°	98.46	kJ/mol	Relay (1.0) Calculated Property
log10WS	-4.91		Relay (1.0) Calculated Property
logPoct/wat	4.585		Crippen Calculated Property
McVol	289.340	ml/mol	McGowan Calculated Property
Pc	1176.85	kPa	Joback Calculated Property
Inp	[1997.00; 1997.00]
Inp	1997.00		NIST
Inp	1997.00		NIST
Tboil	597.07	K	Relay (1.0) Calculated Property
Tc	793.99	K	Relay (1.0) Calculated Property
Tfus	288.71	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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	[897.61; 986.11]	J/mol×K	[777.61; 957.98]
Cp,gas	897.61	J/mol×K	777.61	Joback Calculated Property
Cp,gas	914.92	J/mol×K	807.67	Joback Calculated Property
Cp,gas	931.19	J/mol×K	837.73	Joback Calculated Property
Cp,gas	946.42	J/mol×K	867.79	Joback Calculated Property
Cp,gas	960.64	J/mol×K	897.85	Joback Calculated Property
Cp,gas	973.87	J/mol×K	927.91	Joback Calculated Property
Cp,gas	986.11	J/mol×K	957.98	Joback Calculated Property

Similar Compounds

Find more compounds similar to L-Norvaline, N-propoxycarbonyl-, nonyl ester.

Sources

• Cheméo Relay (1.0)
• 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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