Chemical Properties of Amyloxy iso-eugenol

InChI

InChI=1S/C15H22O3/c1-4-6-7-9-18-14-11-13(16)15(17-3)10-12(14)8-5-2/h5,8,10-11,16H,4,6-7,9H2,1-3H3

InChI Key

CKXKASLJCCTSEX-UHFFFAOYSA-N

Formula

C15H22O3

SMILES

CC=Cc1cc(OC)c(O)cc1OCCCCC

Molecular Weight¹

250.34

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[305.23; 697.42]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			1.18440e+01
Coefficient B			1.27916e+00
Coefficient C			-8.07480e-04
Coefficient D			2.13900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	305.23	J/mol×K	273.00	Calculated Property
Cp,gas	372.79	J/mol×K	353.78	Calculated Property
Cp,gas	432.78	J/mol×K	434.56	Calculated Property
Cp,gas	485.87	J/mol×K	515.33	Calculated Property
Cp,gas	532.74	J/mol×K	596.11	Calculated Property
Cp,gas	574.06	J/mol×K	676.89	Calculated Property
Cp,gas	610.51	J/mol×K	757.67	Calculated Property
Cp,gas	642.78	J/mol×K	838.44	Calculated Property
Cp,gas	671.52	J/mol×K	919.22	Calculated Property
Cp,gas	697.42	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0002140; 0.0000148]	Pa×s	[461.37; 641.51]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.79582e+01
Coefficient B			4.38694e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			461.37
Temperature range, max.			641.51
η	0.0002140	Pa×s	461.37	Calculated Property
η	0.0001441	Pa×s	481.39	Calculated Property
η	0.0001002	Pa×s	501.40	Calculated Property
η	0.0000716	Pa×s	521.42	Calculated Property
η	0.0000524	Pa×s	541.43	Calculated Property
η	0.0000393	Pa×s	561.45	Calculated Property
η	0.0000300	Pa×s	581.46	Calculated Property
η	0.0000234	Pa×s	601.48	Calculated Property
η	0.0000185	Pa×s	621.49	Calculated Property
η	0.0000148	Pa×s	641.51	Calculated Property

Similar Compounds

Find more compounds similar to Amyloxy iso-eugenol.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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