Chemical Properties of Laciniata furanone G

InChI

InChI=1S/C15H22O3/c1-6-14(4)8-7-13(18-14)15(5)12(16)9-11(17-15)10(2)3/h6,11,13H,1-2,7-9H2,3-5H3/t11-,13?,14+,15+/m0/s1

InChI Key

LQWFUFMRXNEVLA-CQFAYMELSA-N

Formula

C15H22O3

SMILES

C=CC1(C)CCC(C2(C)OC(C(=C)C)CC2=O)O1

Molecular Weight¹

250.33

• 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	0.4276		Relay (1.0) Calculated Property
ΔfG°	-5.58	kJ/mol	Joback Calculated Property
ΔfH°gas	-452.45	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	23.62	kJ/mol	Joback Calculated Property
ΔvapH°	73.47	kJ/mol	Relay (1.0) Calculated Property
IE	8.79	eV	Relay (1.0) Calculated Property
log10WS	-2.08		Relay (1.0) Calculated Property
logPoct/wat	2.803		Crippen Calculated Property
McVol	205.200	ml/mol	McGowan Calculated Property
Pc	2127.56	kPa	Joback Calculated Property
Inp	[1493.00; 1498.00]
Inp	1498.00		NIST
Inp	1498.00		NIST
Inp	1493.00		NIST
Tboil	550.96	K	Relay (1.0) Calculated Property
Tc	773.52	K	Relay (1.0) Calculated Property
Tfus	319.79	K	Relay (1.0) Calculated Property
Vc	0.751	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[606.67; 728.55]	J/mol×K	[679.26; 921.44]
Cp,gas	606.67	J/mol×K	679.26	Joback Calculated Property
Cp,gas	628.38	J/mol×K	719.62	Joback Calculated Property
Cp,gas	649.17	J/mol×K	759.99	Joback Calculated Property
Cp,gas	669.31	J/mol×K	800.35	Joback Calculated Property
Cp,gas	689.07	J/mol×K	840.72	Joback Calculated Property
Cp,gas	708.72	J/mol×K	881.08	Joback Calculated Property
Cp,gas	728.55	J/mol×K	921.44	Joback Calculated Property

Similar Compounds

Find more compounds similar to Laciniata furanone G.

Sources

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

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