Chemical Properties of l-Norvaline, n-propoxycarbonyl-, pentadecyl ester

InChI

InChI=1S/C24H47NO4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-21-28-23(26)22(19-5-2)25-24(27)29-20-6-3/h22H,4-21H2,1-3H3,(H,25,27)

InChI Key

UXGXGPHVAMCSAU-UHFFFAOYSA-N

Formula

C24H47NO4

SMILES

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

Molecular Weight¹

413.63

• 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°	68.23	kJ/mol	Joback Calculated Property
ΔvapH°	122.20	kJ/mol	Relay (1.0) Calculated Property
log10WS	-6.77		Relay (1.0) Calculated Property
logPoct/wat	6.926		Crippen Calculated Property
McVol	373.880	ml/mol	McGowan Calculated Property
Pc	820.54	kPa	Joback Calculated Property
Inp	[2496.00; 2496.00]
Inp	2496.00		NIST
Inp	2496.00		NIST
Tboil	638.30	K	Relay (1.0) Calculated Property
Tc	841.13	K	Relay (1.0) Calculated Property
Tfus	313.62	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	[1265.77; 1360.54]	J/mol×K	[914.89; 1122.52]
Cp,gas	1265.77	J/mol×K	914.89	Joback Calculated Property
Cp,gas	1285.37	J/mol×K	949.49	Joback Calculated Property
Cp,gas	1303.39	J/mol×K	984.10	Joback Calculated Property
Cp,gas	1319.88	J/mol×K	1018.70	Joback Calculated Property
Cp,gas	1334.87	J/mol×K	1053.31	Joback Calculated Property
Cp,gas	1348.41	J/mol×K	1087.91	Joback Calculated Property
Cp,gas	1360.54	J/mol×K	1122.52	Joback Calculated Property

Similar Compounds

Find more compounds similar to l-Norvaline, n-propoxycarbonyl-, pentadecyl 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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