Chemical Properties of sec-hexadecylnaphthalene (CAS 94247-63-9)

InChI

InChI=1S/C26H40/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-23(2)25-22-17-20-24-19-15-16-21-26(24)25/h15-17,19-23H,3-14,18H2,1-2H3

InChI Key

YRKSLYAWOBZISP-UHFFFAOYSA-N

Formula

C26H40

SMILES

CCCCCCCCCCCCCCC(C)c1cccc2ccccc12

Molecular Weight¹

352.60

CAS

94247-63-9

• ω : Acentric Factor.
• 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).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• 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_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

Cheméo can also estimate Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, 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	[461.02; 1148.88]	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			-7.34770e+01
Coefficient B			2.33764e+00
Coefficient C			-1.49468e-03
Coefficient D			3.79400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	461.02	J/mol×K	273.00	Calculated Property
Cp,gas	583.26	J/mol×K	353.78	Calculated Property
Cp,gas	691.24	J/mol×K	434.56	Calculated Property
Cp,gas	786.17	J/mol×K	515.33	Calculated Property
Cp,gas	869.25	J/mol×K	596.11	Calculated Property
Cp,gas	941.68	J/mol×K	676.89	Calculated Property
Cp,gas	1004.66	J/mol×K	757.67	Calculated Property
Cp,gas	1059.39	J/mol×K	838.44	Calculated Property
Cp,gas	1107.06	J/mol×K	919.22	Calculated Property
Cp,gas	1148.88	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0012229; 0.0001284]	Pa×s	[439.42; 731.45]	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			-1.23526e+01
Coefficient B			2.48102e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			439.42
Temperature range, max.			731.45
η	0.0012229	Pa×s	439.42	Calculated Property
η	0.0008294	Pa×s	471.87	Calculated Property
η	0.0005914	Pa×s	504.32	Calculated Property
η	0.0004392	Pa×s	536.76	Calculated Property
η	0.0003375	Pa×s	569.21	Calculated Property
η	0.0002668	Pa×s	601.66	Calculated Property
η	0.0002160	Pa×s	634.11	Calculated Property
η	0.0001786	Pa×s	666.56	Calculated Property
η	0.0001502	Pa×s	699.00	Calculated Property
η	0.0001284	Pa×s	731.45	Calculated Property

Similar Compounds

Find more compounds similar to sec-hexadecylnaphthalene.

Sources

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

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