Chemical Properties of Glutaric acid, hept-2-yl 2,4-dichloro-1-naphthyl ester

InChI

InChI=1S/C22H26Cl2O4/c1-3-4-5-9-15(2)27-20(25)12-8-13-21(26)28-22-17-11-7-6-10-16(17)18(23)14-19(22)24/h6-7,10-11,14-15H,3-5,8-9,12-13H2,1-2H3

InChI Key

RIQAWQRLNWKFHN-UHFFFAOYSA-N

Formula

C22H26Cl2O4

SMILES

CCCCCC(C)OC(=O)CCCC(=O)Oc1c(Cl)cc(Cl)c2ccccc12

Molecular Weight¹

425.35

• 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	0.9964		Relay (1.0) Calculated Property
ΔfG°	-169.61	kJ/mol	Joback Calculated Property
ΔfH°gas	-785.65	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	53.07	kJ/mol	Joback Calculated Property
ΔvapH°	119.30	kJ/mol	Relay (1.0) Calculated Property
IE	8.14	eV	Relay (1.0) Calculated Property
log10WS	-6.39		Relay (1.0) Calculated Property
logPoct/wat	6.734		Crippen Calculated Property
McVol	316.980	ml/mol	McGowan Calculated Property
Pc	1300.47	kPa	Joback Calculated Property
Inp	[3050.00; 3050.00]
Inp	3050.00		NIST
Inp	3050.00		NIST
Tboil	683.39	K	Relay (1.0) Calculated Property
Tc	951.21	K	Relay (1.0) Calculated Property
Tfus	341.59	K	Relay (1.0) Calculated Property
Vc	1.155	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[964.72; 1024.18]	J/mol×K	[990.36; 1218.30]
Cp,gas	964.72	J/mol×K	990.36	Joback Calculated Property
Cp,gas	977.28	J/mol×K	1028.35	Joback Calculated Property
Cp,gas	988.70	J/mol×K	1066.34	Joback Calculated Property
Cp,gas	999.04	J/mol×K	1104.33	Joback Calculated Property
Cp,gas	1008.37	J/mol×K	1142.32	Joback Calculated Property
Cp,gas	1016.73	J/mol×K	1180.31	Joback Calculated Property
Cp,gas	1024.18	J/mol×K	1218.30	Joback Calculated Property
η	[0.0000594; 0.0003701]	Pa×s	[623.54; 990.36]
η	0.0003701	Pa×s	623.54	Joback Calculated Property
η	0.0002380	Pa×s	684.68	Joback Calculated Property
η	0.0001646	Pa×s	745.81	Joback Calculated Property
η	0.0001204	Pa×s	806.95	Joback Calculated Property
η	0.0000920	Pa×s	868.09	Joback Calculated Property
η	0.0000728	Pa×s	929.22	Joback Calculated Property
η	0.0000594	Pa×s	990.36	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, hept-2-yl 2,4-dichloro-1-naphthyl ester.

Sources

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

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