Chemical Properties of Glutaric acid, nonyl pentachlorophenyl ester

InChI

InChI=1S/C20H25Cl5O4/c1-2-3-4-5-6-7-8-12-28-13(26)10-9-11-14(27)29-20-18(24)16(22)15(21)17(23)19(20)25/h2-12H2,1H3

InChI Key

KYPOHHPNAMSWNW-UHFFFAOYSA-N

Formula

C20H25Cl5O4

SMILES

CCCCCCCCCOC(=O)CCCC(=O)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl

Molecular Weight¹

506.68

• 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	1.1323		Relay (1.0) Calculated Property
ΔfG°	-345.71	kJ/mol	Joback Calculated Property
ΔfH°gas	-911.40	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	66.21	kJ/mol	Joback Calculated Property
ΔvapH°	125.58	kJ/mol	Relay (1.0) Calculated Property
IE	8.75	eV	Relay (1.0) Calculated Property
log10WS	-8.58		Relay (1.0) Calculated Property
logPoct/wat	8.323		Crippen Calculated Property
McVol	344.980	ml/mol	McGowan Calculated Property
Pc	1129.86	kPa	Joback Calculated Property
Inp	[3324.00; 3324.00]
Inp	3324.00		NIST
Inp	3324.00		NIST
Tboil	687.90	K	Relay (1.0) Calculated Property
Tc	949.50	K	Relay (1.0) Calculated Property
Tfus	359.75	K	Relay (1.0) Calculated Property
Vc	1.278	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[987.64; 1024.82]	J/mol×K	[1048.31; 1283.68]
Cp,gas	987.64	J/mol×K	1048.31	Joback Calculated Property
Cp,gas	997.29	J/mol×K	1087.54	Joback Calculated Property
Cp,gas	1005.53	J/mol×K	1126.77	Joback Calculated Property
Cp,gas	1012.39	J/mol×K	1165.99	Joback Calculated Property
Cp,gas	1017.88	J/mol×K	1205.22	Joback Calculated Property
Cp,gas	1022.02	J/mol×K	1244.45	Joback Calculated Property
Cp,gas	1024.82	J/mol×K	1283.68	Joback Calculated Property
η	[0.0000261; 0.0001438]	Pa×s	[698.10; 1048.31]
η	0.0001438	Pa×s	698.10	Joback Calculated Property
η	0.0000970	Pa×s	756.47	Joback Calculated Property
η	0.0000692	Pa×s	814.84	Joback Calculated Property
η	0.0000517	Pa×s	873.20	Joback Calculated Property
η	0.0000400	Pa×s	931.57	Joback Calculated Property
η	0.0000319	Pa×s	989.94	Joback Calculated Property
η	0.0000261	Pa×s	1048.31	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, nonyl pentachlorophenyl ester.

Sources

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

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