Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, furfuryl pentadecyl ester

InChI

InChI=1S/C28H50O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21-32-27(29)25-19-14-15-20-26(25)28(30)33-23-24-18-17-22-31-24/h24-26H,2-23H2,1H3

InChI Key

VNMFCFCXDJAVQN-UHFFFAOYSA-N

Formula

C28H50O5

SMILES

CCCCCCCCCCCCCCCOC(=O)C1CCCCC1C(=O)OCC1CCCO1

Molecular Weight¹

466.69

• 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	1.1365		Relay (1.0) Calculated Property
ΔfG°	-315.79	kJ/mol	Joback Calculated Property
ΔfH°gas	-1257.18	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	68.67	kJ/mol	Joback Calculated Property
ΔvapH°	135.23	kJ/mol	Relay (1.0) Calculated Property
IE	9.73	eV	Relay (1.0) Calculated Property
log10WS	-6.46		Relay (1.0) Calculated Property
logPoct/wat	7.149		Crippen Calculated Property
McVol	404.410	ml/mol	McGowan Calculated Property
Pc	830.02	kPa	Joback Calculated Property
Inp	[3362.00; 3362.00]
Inp	3362.00		NIST
Inp	3362.00		NIST
Tboil	704.14	K	Relay (1.0) Calculated Property
Tc	924.71	K	Relay (1.0) Calculated Property
Tfus	318.92	K	Relay (1.0) Calculated Property
Vc	1.526	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1499.81; 1578.69]	J/mol×K	[1049.73; 1287.83]
Cp,gas	1499.81	J/mol×K	1049.73	Joback Calculated Property
Cp,gas	1518.24	J/mol×K	1089.41	Joback Calculated Property
Cp,gas	1534.46	J/mol×K	1129.10	Joback Calculated Property
Cp,gas	1548.53	J/mol×K	1168.78	Joback Calculated Property
Cp,gas	1560.54	J/mol×K	1208.46	Joback Calculated Property
Cp,gas	1570.57	J/mol×K	1248.14	Joback Calculated Property
Cp,gas	1578.69	J/mol×K	1287.83	Joback Calculated Property
η	[0.0000277; 0.0004293]	Pa×s	[590.25; 1049.73]
η	0.0004293	Pa×s	590.25	Joback Calculated Property
η	0.0002091	Pa×s	666.83	Joback Calculated Property
η	0.0001181	Pa×s	743.41	Joback Calculated Property
η	0.0000742	Pa×s	819.99	Joback Calculated Property
η	0.0000505	Pa×s	896.57	Joback Calculated Property
η	0.0000365	Pa×s	973.15	Joback Calculated Property
η	0.0000277	Pa×s	1049.73	Joback Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, furfuryl pentadecyl ester.

Sources

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

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