Chemical Properties of Fumaric acid, naphth-1-yl 3-methylbut-2-en-1-yl ester

InChI

InChI=1S/C19H18O4/c1-14(2)12-13-22-18(20)10-11-19(21)23-17-9-5-7-15-6-3-4-8-16(15)17/h3-12H,13H2,1-2H3/b11-10+

InChI Key

AWNKZUPGNJKNNX-ZHACJKMWSA-N

Formula

C19H18O4

SMILES

CC(C)=CCOC(=O)C=CC(=O)Oc1cccc2ccccc12

Molecular Weight¹

310.34

• 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	0.7452		Relay (... Calculated Property
ΔfG°	2.58	kJ/mol	Joback Calculated Property
ΔfH°gas	-478.13	kJ/mol	Relay (... Calculated Property
ΔfusH°	40.30	kJ/mol	Joback Calculated Property
ΔvapH°	107.13	kJ/mol	Relay (... Calculated Property
IE	8.25	eV	Relay (... Calculated Property
log10WS	-5.21		Relay (... Calculated Property
logPoct/wat	3.811		Crippen Calculated Property
McVol	241.630	ml/mol	McGowan Calculated Property
Pc	1923.67	kPa	Joback Calculated Property
Inp	[2540.00; 2540.00]
Inp	2540.00		NIST
Inp	2540.00		NIST
Tboil	657.36	K	Relay (... Calculated Property
Tc	908.68	K	Relay (... Calculated Property
Tfus	341.94	K	Relay (... Calculated Property
Vc	0.841	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[691.47; 760.68]	J/mol×K	[845.54; 1075.55]
Cp,gas	691.47	J/mol×K	845.54	Joback Calculated Property
Cp,gas	705.03	J/mol×K	883.88	Joback Calculated Property
Cp,gas	717.67	J/mol×K	922.21	Joback Calculated Property
Cp,gas	729.46	J/mol×K	960.55	Joback Calculated Property
Cp,gas	740.50	J/mol×K	998.88	Joback Calculated Property
Cp,gas	750.88	J/mol×K	1037.22	Joback Calculated Property
Cp,gas	760.68	J/mol×K	1075.55	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, naphth-1-yl 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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