Chemical Properties of Sarcosine, N-(3-methylbut-2-enoyl)-, decyl ester

InChI

InChI=1S/C18H33NO3/c1-5-6-7-8-9-10-11-12-13-22-18(21)15-19(4)17(20)14-16(2)3/h14H,5-13,15H2,1-4H3

InChI Key

FZIHZZVHLQFWHS-UHFFFAOYSA-N

Formula

C18H33NO3

SMILES

CCCCCCCCCCOC(=O)CN(C)C(=O)C=C(C)C

Molecular Weight¹

311.46

• 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	0.8955		Relay (1.0) Calculated Property
ΔfG°	-79.71	kJ/mol	Joback Calculated Property
ΔfH°gas	-727.04	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	48.67	kJ/mol	Joback Calculated Property
ΔvapH°	94.00	kJ/mol	Relay (1.0) Calculated Property
IE	8.40	eV	Relay (1.0) Calculated Property
log10WS	-4.45		Relay (1.0) Calculated Property
logPoct/wat	4.095		Crippen Calculated Property
McVol	279.170	ml/mol	McGowan Calculated Property
Pc	1292.07	kPa	Joback Calculated Property
Inp	[2302.00; 2302.00]
Inp	2302.00		NIST
Inp	2302.00		NIST
Tboil	597.16	K	Relay (1.0) Calculated Property
Tc	792.82	K	Relay (1.0) Calculated Property
Tfus	302.33	K	Relay (1.0) Calculated Property
Vc	1.051	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[836.42; 927.73]	J/mol×K	[757.88; 940.02]
Cp,gas	836.42	J/mol×K	757.88	Joback Calculated Property
Cp,gas	853.79	J/mol×K	788.24	Joback Calculated Property
Cp,gas	870.25	J/mol×K	818.59	Joback Calculated Property
Cp,gas	885.84	J/mol×K	848.95	Joback Calculated Property
Cp,gas	900.59	J/mol×K	879.31	Joback Calculated Property
Cp,gas	914.54	J/mol×K	909.66	Joback Calculated Property
Cp,gas	927.73	J/mol×K	940.02	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sarcosine, N-(3-methylbut-2-enoyl)-, decyl ester.

Sources

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

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