Chemical Properties of Turmerone (dihydro-ar) (CAS 4179-20-8)

InChI

InChI=1S/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5-8,11,13H,9-10H2,1-4H3

InChI Key

FWSUEHMNQCROMJ-UHFFFAOYSA-N

Formula

C15H22O

SMILES

Cc1ccc(C(C)CC(=O)CC(C)C)cc1

Molecular Weight¹

218.33

CAS

4179-20-8

Other Names

• Dihydro-Ar-turmerone

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.5416		Relay (1.0) Calculated Property
ΔfH°gas	-261.05	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	22.81	kJ/mol	Joback Calculated Property
ΔvapH°	71.84	kJ/mol	Relay (1.0) Calculated Property
IE	8.33	eV	Relay (1.0) Calculated Property
log10WS	-4.28		Relay (1.0) Calculated Property
logPoct/wat	4.104		Crippen Calculated Property
McVol	200.020	ml/mol	McGowan Calculated Property
Pc	1952.68	kPa	Joback Calculated Property
Inp	[1586.00; 1591.00]
Inp	1586.00		NIST
Inp	1591.00		NIST
Inp	1586.00		NIST
Inp	1591.00		NIST
Tboil	545.03	K	Relay (1.0) Calculated Property
Tc	763.10	K	Relay (1.0) Calculated Property
Tfus	308.54	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[519.25; 610.88]	J/mol×K	[627.45; 835.24]
Cp,gas	519.25	J/mol×K	627.45	Joback Calculated Property
Cp,gas	536.97	J/mol×K	662.08	Joback Calculated Property
Cp,gas	553.66	J/mol×K	696.71	Joback Calculated Property
Cp,gas	569.36	J/mol×K	731.35	Joback Calculated Property
Cp,gas	584.10	J/mol×K	765.98	Joback Calculated Property
Cp,gas	597.93	J/mol×K	800.61	Joback Calculated Property
Cp,gas	610.88	J/mol×K	835.24	Joback Calculated Property
η	[0.0001478; 0.0034484]	Pa×s	[317.68; 627.45]
η	0.0034484	Pa×s	317.68	Joback Calculated Property
η	0.0014134	Pa×s	369.31	Joback Calculated Property
η	0.0007210	Pa×s	420.94	Joback Calculated Property
η	0.0004261	Pa×s	472.57	Joback Calculated Property
η	0.0002793	Pa×s	524.19	Joback Calculated Property
η	0.0001974	Pa×s	575.82	Joback Calculated Property
η	0.0001478	Pa×s	627.45	Joback Calculated Property

Similar Compounds

Find more compounds similar to Turmerone (dihydro-ar).

Sources

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

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