Chemical Properties of 2-(Hexyloxy)benzaldehyde (CAS 7162-59-6)

InChI

InChI=1S/C13H18O2/c1-2-3-4-7-10-15-13-9-6-5-8-12(13)11-14/h5-6,8-9,11H,2-4,7,10H2,1H3

InChI Key

IFOIDROUJIGQAV-UHFFFAOYSA-N

Formula

C13H18O2

SMILES

CCCCCCOc1ccccc1C=O

Molecular Weight¹

206.28

CAS

7162-59-6

Other Names

• o-Hexyloxybenzaldehyde
• 2-n-Hexyloxybenzaldehyde
• Benzaldehyde, 2-(hexyloxy)-
• Benzaldehyde, o-(n-hexyloxy)-,

• 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).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (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 Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[246.87; 577.73]	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			8.36500e+00
Coefficient B			1.01172e+00
Coefficient C			-5.29560e-04
Coefficient D			8.72000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	246.87	J/mol×K	273.00	Calculated Property
Cp,gas	303.87	J/mol×K	353.78	Calculated Property
Cp,gas	355.17	J/mol×K	434.56	Calculated Property
Cp,gas	401.04	J/mol×K	515.33	Calculated Property
Cp,gas	441.76	J/mol×K	596.11	Calculated Property
Cp,gas	477.60	J/mol×K	676.89	Calculated Property
Cp,gas	508.84	J/mol×K	757.67	Calculated Property
Cp,gas	535.76	J/mol×K	838.44	Calculated Property
Cp,gas	558.63	J/mol×K	919.22	Calculated Property
Cp,gas	577.73	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0018840; 0.0002256]	Pa×s	[339.44; 559.54]	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			-1.16697e+01
Coefficient B			1.83140e+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.			339.44
Temperature range, max.			559.54
η	0.0018840	Pa×s	339.44	Calculated Property
η	0.0013110	Pa×s	363.90	Calculated Property
η	0.0009549	Pa×s	388.35	Calculated Property
η	0.0007222	Pa×s	412.81	Calculated Property
η	0.0005635	Pa×s	437.26	Calculated Property
η	0.0004514	Pa×s	461.72	Calculated Property
η	0.0003697	Pa×s	486.17	Calculated Property
η	0.0003087	Pa×s	510.63	Calculated Property
η	0.0002620	Pa×s	535.08	Calculated Property
η	0.0002256	Pa×s	559.54	Calculated Property

Similar Compounds

Find more compounds similar to 2-(Hexyloxy)benzaldehyde.

Sources

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

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