Chemical Properties of Sarcosine, N-(2,6-difluorobenzoyl)-, nonyl ester

InChI

InChI=1S/C19H27F2NO3/c1-3-4-5-6-7-8-9-13-25-17(23)14-22(2)19(24)18-15(20)11-10-12-16(18)21/h10-12H,3-9,13-14H2,1-2H3

InChI Key

WLVAVMFHHVHICE-UHFFFAOYSA-N

Formula

C19H27F2NO3

SMILES

CCCCCCCCCOC(=O)CN(C)C(=O)c1c(F)cccc1F

Molecular Weight¹

355.42

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfG°	-439.43	kJ/mol	Joback Calculated Property
ΔfH°gas	-903.97	kJ/mol	Joback Calculated Property
ΔfusH°	51.80	kJ/mol	Joback Calculated Property
ΔvapH°	77.80	kJ/mol	Joback Calculated Property
log10WS	-5.33		Crippen Calculated Property
logPoct/wat	4.331		Crippen Calculated Property
McVol	277.340	ml/mol	McGowan Calculated Property
Pc	1347.68	kPa	Joback Calculated Property
Inp	[2518.00; 2518.00]
Inp	2518.00		NIST
Inp	2518.00		NIST
Tboil	811.90	K	Joback Calculated Property
Tc	1002.82	K	Joback Calculated Property
Tfus	511.09	K	Joback Calculated Property
Vc	1.075	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[846.08; 924.59]	J/mol×K	[811.90; 1002.82]
Cp,gas	846.08	J/mol×K	811.90	Joback Calculated Property
Cp,gas	861.51	J/mol×K	843.72	Joback Calculated Property
Cp,gas	875.95	J/mol×K	875.54	Joback Calculated Property
Cp,gas	889.45	J/mol×K	907.36	Joback Calculated Property
Cp,gas	902.03	J/mol×K	939.18	Joback Calculated Property
Cp,gas	913.73	J/mol×K	971.00	Joback Calculated Property
Cp,gas	924.59	J/mol×K	1002.82	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(2,6-difluorobenzoyl)-, nonyl ester.

Sources

• 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.