Chemical Properties of Sarcosine, N-(1-naphthoyl)-, pentyl ester

InChI

InChI=1S/C19H23NO3/c1-3-4-7-13-23-18(21)14-20(2)19(22)17-12-8-10-15-9-5-6-11-16(15)17/h5-6,8-12H,3-4,7,13-14H2,1-2H3

InChI Key

GMLAGKZURTUBGK-UHFFFAOYSA-N

Formula

C19H23NO3

SMILES

CCCCCOC(=O)CN(C)C(=O)c1cccc2ccccc12

Molecular Weight¹

313.39

• 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).
• IE : Ionization energy (eV).
• 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfH°gas	-435.77	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	44.63	kJ/mol	Joback Calculated Property
ΔvapH°	105.93	kJ/mol	Relay (1.0) Calculated Property
IE	8.05	eV	Relay (1.0) Calculated Property
log10WS	-4.19		Relay (1.0) Calculated Property
logPoct/wat	3.645		Crippen Calculated Property
McVol	254.340	ml/mol	McGowan Calculated Property
Pc	1714.61	kPa	Joback Calculated Property
Inp	[2612.00; 2612.00]
Inp	2612.00		NIST
Inp	2612.00		NIST
Tboil	674.94	K	Relay (1.0) Calculated Property
Tfus	327.99	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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	[753.87; 828.54]	J/mol×K	[809.49; 1021.68]
Cp,gas	753.87	J/mol×K	809.49	Joback Calculated Property
Cp,gas	768.77	J/mol×K	844.85	Joback Calculated Property
Cp,gas	782.60	J/mol×K	880.22	Joback Calculated Property
Cp,gas	795.42	J/mol×K	915.58	Joback Calculated Property
Cp,gas	807.30	J/mol×K	950.95	Joback Calculated Property
Cp,gas	818.32	J/mol×K	986.31	Joback Calculated Property
Cp,gas	828.54	J/mol×K	1021.68	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(1-naphthoyl)-, pentyl 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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