Chemical Properties of Glutaric acid, 2-norbornyl 2-chloro-6-fluorophenyl ester

InChI

InChI=1S/C18H20ClFO4/c19-13-3-1-4-14(20)18(13)24-17(22)6-2-5-16(21)23-15-10-11-7-8-12(15)9-11/h1,3-4,11-12,15H,2,5-10H2

InChI Key

ZVPJPUJXGKQTCW-UHFFFAOYSA-N

Formula

C18H20ClFO4

SMILES

O=C(CCCC(=O)OC1CC2CCC1C2)Oc1c(F)cccc1Cl

Molecular Weight¹

354.80

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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	0.7922		Relay (... Calculated Property
ΔfG°	-379.06	kJ/mol	Joback Calculated Property
ΔfH°gas	-898.11	kJ/mol	Relay (... Calculated Property
ΔfusH°	43.73	kJ/mol	Joback Calculated Property
ΔvapH°	104.91	kJ/mol	Relay (... Calculated Property
IE	8.74	eV	Relay (... Calculated Property
log10WS	-5.22		Relay (... Calculated Property
logPoct/wat	4.287		Crippen Calculated Property
McVol	247.890	ml/mol	McGowan Calculated Property
Pc	1760.97	kPa	Joback Calculated Property
Inp	[2499.00; 2499.00]
Inp	2499.00		NIST
Inp	2499.00		NIST
Tboil	638.26	K	Relay (... Calculated Property
Tc	911.50	K	Relay (... Calculated Property
Tfus	369.56	K	Relay (... Calculated Property
Vc	0.918	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[768.31; 841.10]	J/mol×K	[850.24; 1070.62]
Cp,gas	768.31	J/mol×K	850.24	Joback Calculated Property
Cp,gas	783.07	J/mol×K	886.97	Joback Calculated Property
Cp,gas	796.70	J/mol×K	923.70	Joback Calculated Property
Cp,gas	809.26	J/mol×K	960.43	Joback Calculated Property
Cp,gas	820.80	J/mol×K	997.16	Joback Calculated Property
Cp,gas	831.40	J/mol×K	1033.89	Joback Calculated Property
Cp,gas	841.10	J/mol×K	1070.62	Joback Calculated Property

Similar Compounds

Find more compounds similar to Glutaric acid, 2-norbornyl 2-chloro-6-fluorophenyl ester.

Sources

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

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