Chemical Properties of GA73, Me

InChI

InChI=1S/C20H24O4/c1-11-9-19-10-12(11)5-6-13(19)20-8-4-7-18(2,17(22)24-20)15(20)14(19)16(21)23-3/h6,12,14-15H,1,4-5,7-10H2,2-3H3/t12-,14-,15?,18-,19+,20-/m0/s1

InChI Key

HQSDLFRIZKDOEE-SRYNXPEOSA-N

Formula

C20H24O4

SMILES

C=C1CC23CC1CC=C2C12CCCC(C)(C(=O)O1)C2C3C(=O)OC

Molecular Weight¹

328.40

Other Names

• GA73, Methyl ester

• 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	0.5012		Relay (1.0) Calculated Property
ΔfG°	3.67	kJ/mol	Joback Calculated Property
ΔfH°gas	-611.27	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	26.16	kJ/mol	Joback Calculated Property
ΔvapH°	102.17	kJ/mol	Relay (1.0) Calculated Property
IE	8.75	eV	Relay (1.0) Calculated Property
log10WS	-3.92		Relay (1.0) Calculated Property
logPoct/wat	3.174		Crippen Calculated Property
McVol	244.640	ml/mol	McGowan Calculated Property
Pc	2021.76	kPa	Joback Calculated Property
Inp	[2325.00; 2344.00]
Inp	2344.00		NIST
Inp	2325.00		NIST
Inp	2326.00		NIST
Inp	2329.00		NIST
Inp	2326.00		NIST
Inp	2344.00		NIST
Tboil	627.36	K	Relay (1.0) Calculated Property
Tc	929.15	K	Relay (1.0) Calculated Property
Tfus	390.14	K	Relay (1.0) Calculated Property
Vc	0.901	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[853.47; 1049.75]	J/mol×K	[869.65; 1121.85]
Cp,gas	853.47	J/mol×K	869.65	Joback Calculated Property
Cp,gas	879.99	J/mol×K	911.68	Joback Calculated Property
Cp,gas	908.21	J/mol×K	953.72	Joback Calculated Property
Cp,gas	938.73	J/mol×K	995.75	Joback Calculated Property
Cp,gas	972.10	J/mol×K	1037.79	Joback Calculated Property
Cp,gas	1008.92	J/mol×K	1079.82	Joback Calculated Property
Cp,gas	1049.75	J/mol×K	1121.85	Joback Calculated Property

Similar Compounds

Find more compounds similar to GA73, Me.

Sources

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

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