Chemical Properties of Dimethylmalonic acid, decyl 4-(4-methoxyphenyl)cyclohexyl ester

InChI

InChI=1S/C28H44O5/c1-5-6-7-8-9-10-11-12-21-32-26(29)28(2,3)27(30)33-25-19-15-23(16-20-25)22-13-17-24(31-4)18-14-22/h13-14,17-18,23,25H,5-12,15-16,19-21H2,1-4H3

InChI Key

FARJRDIZHIVRNG-UHFFFAOYSA-N

Formula

C28H44O5

SMILES

CCCCCCCCCCOC(=O)C(C)(C)C(=O)OC1CCC(c2ccc(OC)cc2)CC1

Molecular Weight¹

460.65

• ω : Acentric Factor.
• 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).
• 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	1.0733		Relay (... Calculated Property
ΔfG°	-265.60	kJ/mol	Joback Calculated Property
ΔfH°gas	-1060.74	kJ/mol	Relay (... Calculated Property
ΔfusH°	54.18	kJ/mol	Joback Calculated Property
ΔvapH°	127.40	kJ/mol	Relay (... Calculated Property
IE	8.35	eV	Relay (... Calculated Property
log10WS	-6.75		Relay (... Calculated Property
logPoct/wat	6.975		Crippen Calculated Property
McVol	391.510	ml/mol	McGowan Calculated Property
Pc	905.06	kPa	Joback Calculated Property
Inp	[3398.00; 3398.00]
Inp	3398.00		NIST
Inp	3398.00		NIST
Tboil	711.06	K	Relay (... Calculated Property
Tc	936.66	K	Relay (... Calculated Property
Tfus	325.67	K	Relay (... Calculated Property
Vc	1.446	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1395.87; 1459.92]	J/mol×K	[1058.35; 1295.73]
Cp,gas	1395.87	J/mol×K	1058.35	Joback Calculated Property
Cp,gas	1411.42	J/mol×K	1097.91	Joback Calculated Property
Cp,gas	1424.92	J/mol×K	1137.48	Joback Calculated Property
Cp,gas	1436.45	J/mol×K	1177.04	Joback Calculated Property
Cp,gas	1446.08	J/mol×K	1216.60	Joback Calculated Property
Cp,gas	1453.88	J/mol×K	1256.17	Joback Calculated Property
Cp,gas	1459.92	J/mol×K	1295.73	Joback Calculated Property
η	[0.0000127; 0.0001794]	Pa×s	[616.37; 1058.35]
η	0.0001794	Pa×s	616.37	Joback Calculated Property
η	0.0000912	Pa×s	690.03	Joback Calculated Property
η	0.0000528	Pa×s	763.70	Joback Calculated Property
η	0.0000337	Pa×s	837.36	Joback Calculated Property
η	0.0000231	Pa×s	911.02	Joback Calculated Property
η	0.0000168	Pa×s	984.69	Joback Calculated Property
η	0.0000127	Pa×s	1058.35	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dimethylmalonic acid, decyl 4-(4-methoxyphenyl)cyclohexyl ester.

Sources

• Cheméo Relay (1.0)
• 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.