Chemical Properties of Phthalic acid, 2,5-dichlorobenzyl decyl ester

InChI

InChI=1S/C25H30Cl2O4/c1-2-3-4-5-6-7-8-11-16-30-24(28)21-12-9-10-13-22(21)25(29)31-18-19-17-20(26)14-15-23(19)27/h9-10,12-15,17H,2-8,11,16,18H2,1H3

InChI Key

VJHLIFIENCKONI-UHFFFAOYSA-N

Formula

C25H30Cl2O4

SMILES

CCCCCCCCCCOC(=O)c1ccccc1C(=O)OCc1cc(Cl)ccc1Cl

Molecular Weight¹

465.41

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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
ω	1.1400		Relay (1.0) Calculated Property
ΔfH°gas	-752.08	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	61.39	kJ/mol	Joback Calculated Property
ΔvapH°	128.52	kJ/mol	Relay (1.0) Calculated Property
log10WS	-8.18		Relay (1.0) Calculated Property
logPoct/wat	7.648		Crippen Calculated Property
McVol	354.950	ml/mol	McGowan Calculated Property
Pc	1123.81	kPa	Joback Calculated Property
Inp	[3220.00; 3220.00]
Inp	3220.00		NIST
Inp	3220.00		NIST
Tboil	711.38	K	Relay (1.0) Calculated Property
Tc	965.49	K	Relay (1.0) Calculated Property
Tfus	305.51	K	Relay (1.0) Calculated Property
Vc	1.303	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1117.37; 1164.96]	J/mol×K	[1067.14; 1307.11]
Cp,gas	1117.37	J/mol×K	1067.14	Joback Calculated Property
Cp,gas	1128.87	J/mol×K	1107.14	Joback Calculated Property
Cp,gas	1138.87	J/mol×K	1147.13	Joback Calculated Property
Cp,gas	1147.42	J/mol×K	1187.13	Joback Calculated Property
Cp,gas	1154.58	J/mol×K	1227.12	Joback Calculated Property
Cp,gas	1160.41	J/mol×K	1267.12	Joback Calculated Property
Cp,gas	1164.96	J/mol×K	1307.11	Joback Calculated Property
η	[0.0000205; 0.0001613]	Pa×s	[666.07; 1067.14]
η	0.0001613	Pa×s	666.07	Joback Calculated Property
η	0.0000978	Pa×s	732.91	Joback Calculated Property
η	0.0000644	Pa×s	799.76	Joback Calculated Property
η	0.0000453	Pa×s	866.61	Joback Calculated Property
η	0.0000335	Pa×s	933.45	Joback Calculated Property
η	0.0000258	Pa×s	1000.29	Joback Calculated Property
η	0.0000205	Pa×s	1067.14	Joback Calculated Property

Similar Compounds

Find more compounds similar to Phthalic acid, 2,5-dichlorobenzyl decyl 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.