Chemical Properties of Benzene, 1,3-dimethoxy-4-heptyl

InChI

InChI=1S/C15H24O2/c1-4-5-6-7-8-9-13-10-11-14(16-2)12-15(13)17-3/h10-12H,4-9H2,1-3H3

InChI Key

FQMKORGESTUPOF-UHFFFAOYSA-N

Formula

C15H24O2

SMILES

CCCCCCCc1ccc(OC)cc1OC

Molecular Weight¹

236.36

• 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).
• 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).
• I_np : Non-polar retention indices.
• 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 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	[302.34; 705.59]	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			3.49460e+01
Coefficient B			1.10456e+00
Coefficient C			-4.67320e-04
Coefficient D			3.34000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	302.34	J/mol×K	273.00	Calculated Property
Cp,gas	368.70	J/mol×K	353.78	Calculated Property
Cp,gas	429.43	J/mol×K	434.56	Calculated Property
Cp,gas	484.63	J/mol×K	515.33	Calculated Property
Cp,gas	534.40	J/mol×K	596.11	Calculated Property
Cp,gas	578.85	J/mol×K	676.89	Calculated Property
Cp,gas	618.09	J/mol×K	757.67	Calculated Property
Cp,gas	652.22	J/mol×K	838.44	Calculated Property
Cp,gas	681.35	J/mol×K	919.22	Calculated Property
Cp,gas	705.59	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010288; 0.0001359]	Pa×s	[354.73; 570.59]	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			-1.22297e+01
Coefficient B			1.89792e+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.			354.73
Temperature range, max.			570.59
η	0.0010288	Pa×s	354.73	Calculated Property
η	0.0007331	Pa×s	378.71	Calculated Property
η	0.0005439	Pa×s	402.70	Calculated Property
η	0.0004173	Pa×s	426.68	Calculated Property
η	0.0003294	Pa×s	450.67	Calculated Property
η	0.0002662	Pa×s	474.65	Calculated Property
η	0.0002197	Pa×s	498.64	Calculated Property
η	0.0001845	Pa×s	522.62	Calculated Property
η	0.0001573	Pa×s	546.61	Calculated Property
η	0.0001359	Pa×s	570.59	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 1,3-dimethoxy-4-heptyl.

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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