Chemical Properties of Succinic acid, cyclohexylmethyl 3-methylbut-2-en-1-yl ester

InChI

InChI=1S/C16H26O4/c1-13(2)10-11-19-15(17)8-9-16(18)20-12-14-6-4-3-5-7-14/h10,14H,3-9,11-12H2,1-2H3

InChI Key

NMZMZAPCRLGSJK-UHFFFAOYSA-N

Formula

C16H26O4

SMILES

CC(C)=CCOC(=O)CCC(=O)OCC1CCCCC1

Molecular Weight¹

282.38

• 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	0.6795		Relay (... Calculated Property
ΔfG°	-287.88	kJ/mol	Joback Calculated Property
ΔfH°gas	-870.17	kJ/mol	Relay (... Calculated Property
ΔfusH°	33.50	kJ/mol	Joback Calculated Property
ΔvapH°	85.58	kJ/mol	Relay (... Calculated Property
IE	8.68	eV	Relay (... Calculated Property
log10WS	-4.07		Relay (... Calculated Property
logPoct/wat	3.399		Crippen Calculated Property
McVol	236.020	ml/mol	McGowan Calculated Property
Pc	1736.11	kPa	Joback Calculated Property
Inp	[2051.00; 2051.00]
Inp	2051.00		NIST
Inp	2051.00		NIST
Tboil	613.44	K	Relay (... Calculated Property
Tc	792.06	K	Relay (... Calculated Property
Tfus	269.34	K	Relay (... Calculated Property
Vc	0.847	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[704.88; 796.45]	J/mol×K	[741.65; 946.50]
Cp,gas	704.88	J/mol×K	741.65	Joback Calculated Property
Cp,gas	722.96	J/mol×K	775.79	Joback Calculated Property
Cp,gas	739.87	J/mol×K	809.93	Joback Calculated Property
Cp,gas	755.65	J/mol×K	844.07	Joback Calculated Property
Cp,gas	770.32	J/mol×K	878.22	Joback Calculated Property
Cp,gas	783.92	J/mol×K	912.36	Joback Calculated Property
Cp,gas	796.45	J/mol×K	946.50	Joback Calculated Property

Similar Compounds

Find more compounds similar to Succinic acid, cyclohexylmethyl 3-methylbut-2-en-1-yl ester.

Sources

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

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