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

InChI

InChI=1S/C14H20F7NO3/c1-3-4-5-6-7-8-25-10(23)9-22(2)11(24)12(15,16)13(17,18)14(19,20)21/h3-9H2,1-2H3

InChI Key

UTHMOGRSMJPFQD-UHFFFAOYSA-N

Formula

C14H20F7NO3

SMILES

CCCCCCCOC(=O)CN(C)C(=O)C(F)(F)C(F)(F)C(F)(F)F

Molecular Weight¹

383.30

• 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°	-1540.21	kJ/mol	Joback Calculated Property
ΔfH°gas	-2021.16	kJ/mol	Joback Calculated Property
ΔfusH°	38.74	kJ/mol	Joback Calculated Property
ΔvapH°	55.10	kJ/mol	Joback Calculated Property
log10WS	-4.18		Crippen Calculated Property
logPoct/wat	3.791		Crippen Calculated Property
McVol	239.500	ml/mol	McGowan Calculated Property
Pc	1358.63	kPa	Joback Calculated Property
Inp	[1580.00; 1580.00]
Inp	1580.00		NIST
Inp	1580.00		NIST
Tboil	647.52	K	Joback Calculated Property
Tc	805.68	K	Joback Calculated Property
Tfus	413.49	K	Joback Calculated Property
Vc	0.961	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[696.69; 769.22]	J/mol×K	[647.52; 805.68]
Cp,gas	696.69	J/mol×K	647.52	Joback Calculated Property
Cp,gas	710.64	J/mol×K	673.88	Joback Calculated Property
Cp,gas	723.79	J/mol×K	700.24	Joback Calculated Property
Cp,gas	736.18	J/mol×K	726.60	Joback Calculated Property
Cp,gas	747.85	J/mol×K	752.96	Joback Calculated Property
Cp,gas	758.85	J/mol×K	779.32	Joback Calculated Property
Cp,gas	769.22	J/mol×K	805.68	Joback Calculated Property

Similar Compounds

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

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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