Chemical Properties of Fumaric acid, di(3-methylbut-2-yl) ester

InChI

InChI=1S/C14H24O4/c1-9(2)11(5)17-13(15)7-8-14(16)18-12(6)10(3)4/h7-12H,1-6H3/b8-7+

InChI Key

XNGKHZVNBSVEOW-BQYQJAHWSA-N

Formula

C14H24O4

SMILES

CC(C)C(C)OC(=O)C=CC(=O)OC(C)C(C)C

Molecular Weight¹

256.34

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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°	-330.38	kJ/mol	Joback Calculated Property
ΔfH°gas	-725.79	kJ/mol	Joback Calculated Property
ΔfusH°	23.70	kJ/mol	Joback Calculated Property
ΔvapH°	63.48	kJ/mol	Joback Calculated Property
log10WS	-3.00		Crippen Calculated Property
logPoct/wat	2.718		Crippen Calculated Property
McVol	218.700	ml/mol	McGowan Calculated Property
Pc	1756.54	kPa	Joback Calculated Property
Inp	[1599.00; 1599.00]
Inp	1599.00		NIST
Inp	1599.00		NIST
Tboil	674.70	K	Joback Calculated Property
Tc	867.18	K	Joback Calculated Property
Tfus	326.78	K	Joback Calculated Property
Vc	0.824	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[602.02; 686.64]	J/mol×K	[674.70; 867.18]
Cp,gas	602.02	J/mol×K	674.70	Joback Calculated Property
Cp,gas	618.24	J/mol×K	706.78	Joback Calculated Property
Cp,gas	633.59	J/mol×K	738.86	Joback Calculated Property
Cp,gas	648.09	J/mol×K	770.94	Joback Calculated Property
Cp,gas	661.76	J/mol×K	803.02	Joback Calculated Property
Cp,gas	674.60	J/mol×K	835.10	Joback Calculated Property
Cp,gas	686.64	J/mol×K	867.18	Joback Calculated Property
η	[0.0000761; 0.0038904]	Pa×s	[326.78; 674.70]
η	0.0038904	Pa×s	326.78	Joback Calculated Property
η	0.0012323	Pa×s	384.77	Joback Calculated Property
η	0.0005275	Pa×s	442.75	Joback Calculated Property
η	0.0002748	Pa×s	500.74	Joback Calculated Property
η	0.0001639	Pa×s	558.73	Joback Calculated Property
η	0.0001078	Pa×s	616.71	Joback Calculated Property
η	0.0000761	Pa×s	674.70	Joback Calculated Property

Similar Compounds

Find more compounds similar to Fumaric acid, di(3-methylbut-2-yl) ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.