Chemical Properties of GA11, Me

InChI

InChI=1S/C20H24O5/c1-9-6-19-7-10(9)4-5-12(19)20-14(13(19)16(21)23-3)18(2)8-11(15(20)25-20)24-17(18)22/h10-15H,1,4-8H2,2-3H3/t10-,11+,12?,13-,14?,15-,18-,19+,20+/m0/s1

InChI Key

NGYXRXKRMVHSLN-NGMLVCFKSA-N

Formula

C20H24O5

SMILES

C=C1CC23CC1CCC2C12OC1C1CC(C)(C(=O)O1)C2C3C(=O)OC

Molecular Weight¹

344.40

• 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	0.5448		Relay (... Calculated Property
ΔfG°	-33.25	kJ/mol	Joback Calculated Property
ΔfH°gas	-706.66	kJ/mol	Relay (... Calculated Property
ΔfusH°	37.78	kJ/mol	Joback Calculated Property
ΔvapH°	110.77	kJ/mol	Relay (... Calculated Property
IE	9.22	eV	Relay (... Calculated Property
log10WS	-3.65		Relay (... Calculated Property
logPoct/wat	2.241		Crippen Calculated Property
McVol	243.950	ml/mol	McGowan Calculated Property
Pc	1992.98	kPa	Joback Calculated Property
Inp	[2402.00; 2402.00]
Inp	2402.00		NIST
Inp	2402.00		NIST
Tboil	647.40	K	Relay (... Calculated Property
Tc	961.18	K	Relay (... Calculated Property
Tfus	407.56	K	Relay (... Calculated Property
Vc	0.955	m3/kmol	Relay (... Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[900.47; 1106.78]	J/mol×K	[881.32; 1128.93]
Cp,gas	900.47	J/mol×K	881.32	Joback Calculated Property
Cp,gas	927.98	J/mol×K	922.59	Joback Calculated Property
Cp,gas	957.44	J/mol×K	963.86	Joback Calculated Property
Cp,gas	989.46	J/mol×K	1005.13	Joback Calculated Property
Cp,gas	1024.62	J/mol×K	1046.39	Joback Calculated Property
Cp,gas	1063.53	J/mol×K	1087.66	Joback Calculated Property
Cp,gas	1106.78	J/mol×K	1128.93	Joback Calculated Property

Similar Compounds

Find more compounds similar to GA11, Me.

Sources

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

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