Chemical Properties of Teferin

InChI

InChI=1S/C23H32O5/c1-14(2)23(26)11-10-22(4)9-8-15(3)12-19(20(22)23)28-21(25)16-6-7-17(24)18(13-16)27-5/h6-8,13-14,19-20,24,26H,9-12H2,1-5H3/t19-,20+,22+,23+/m0/s1

InChI Key

YEQVRBJRNFLOQJ-KKSHJYNMSA-N

Formula

C23H32O5

SMILES

COc1cc(C(=O)OC2CC(C)=CCC3(C)CCC(O)(C(C)C)C23)ccc1O

Molecular Weight¹

388.50

• 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).
• 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
ΔfG°	-320.21	kJ/mol	Joback Calculated Property
ΔfH°gas	-847.76	kJ/mol	Joback Calculated Property
ΔfusH°	37.55	kJ/mol	Joback Calculated Property
ΔvapH°	109.15	kJ/mol	Joback Calculated Property
log10WS	-5.65		Crippen Calculated Property
logPoct/wat	4.470		Crippen Calculated Property
McVol	310.200	ml/mol	McGowan Calculated Property
Pc	1697.70	kPa	Joback Calculated Property
Inp	[2858.00; 2858.00]
Inp	2858.00		NIST
Inp	2858.00		NIST
Tboil	1054.21	K	Joback Calculated Property
Tc	1296.97	K	Joback Calculated Property
Tfus	714.24	K	Joback Calculated Property
Vc	1.099	m3/kmol	Joback Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1150.23; 1363.30]	J/mol×K	[1054.21; 1296.97]
Cp,gas	1150.23	J/mol×K	1054.21	Joback Calculated Property
Cp,gas	1180.19	J/mol×K	1094.67	Joback Calculated Property
Cp,gas	1211.90	J/mol×K	1135.13	Joback Calculated Property
Cp,gas	1245.72	J/mol×K	1175.59	Joback Calculated Property
Cp,gas	1281.99	J/mol×K	1216.05	Joback Calculated Property
Cp,gas	1321.06	J/mol×K	1256.51	Joback Calculated Property
Cp,gas	1363.30	J/mol×K	1296.97	Joback Calculated Property

Similar Compounds

Find more compounds similar to Teferin.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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