Chemical Properties of Sarcosine, n-heptafluorobutyryl-, tetradecyl ester

InChI

InChI=1S/C21H34F7NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-32-17(30)16-29(2)18(31)19(22,23)20(24,25)21(26,27)28/h3-16H2,1-2H3

InChI Key

BBWZOJDUVGYTDC-UHFFFAOYSA-N

Formula

C21H34F7NO3

SMILES

CCCCCCCCCCCCCCOC(=O)CN(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

481.49

• ω : Acentric Factor.
• 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).
• 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_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
ω	1.0429		Relay (1.0) Calculated Property
ΔfG°	-1481.27	kJ/mol	Joback Calculated Property
ΔfH°gas	-2290.30	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	56.87	kJ/mol	Joback Calculated Property
ΔvapH°	103.62	kJ/mol	Relay (1.0) Calculated Property
IE	9.32	eV	Relay (1.0) Calculated Property
log10WS	-7.00		Relay (1.0) Calculated Property
logPoct/wat	6.522		Crippen Calculated Property
McVol	338.130	ml/mol	McGowan Calculated Property
Pc	872.74	kPa	Joback Calculated Property
Inp	[2244.00; 2244.00]
Inp	2244.00		NIST
Inp	2244.00		NIST
Tboil	596.18	K	Relay (1.0) Calculated Property
Tc	719.04	K	Relay (1.0) Calculated Property
Tfus	280.96	K	Relay (1.0) Calculated Property
Vc	1.278	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1096.20; 1186.72]	J/mol×K	[807.68; 989.21]
Cp,gas	1096.20	J/mol×K	807.68	Joback Calculated Property
Cp,gas	1113.61	J/mol×K	837.94	Joback Calculated Property
Cp,gas	1129.98	J/mol×K	868.19	Joback Calculated Property
Cp,gas	1145.40	J/mol×K	898.45	Joback Calculated Property
Cp,gas	1159.95	J/mol×K	928.70	Joback Calculated Property
Cp,gas	1173.70	J/mol×K	958.96	Joback Calculated Property
Cp,gas	1186.72	J/mol×K	989.21	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, n-heptafluorobutyryl-, tetradecyl ester.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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