Chemical Properties of Phenanthrene, 2-dodecyl- (CAS 3674-72-4)

InChI

InChI=1S/C26H34/c1-2-3-4-5-6-7-8-9-10-11-14-22-17-20-26-24(21-22)19-18-23-15-12-13-16-25(23)26/h12-13,15-21H,2-11,14H2,1H3

InChI Key

STXCMFGUPUBXHF-UHFFFAOYSA-N

Formula

C26H34

SMILES

CCCCCCCCCCCCc1ccc2c(ccc3ccccc32)c1

Molecular Weight¹

346.55

CAS

3674-72-4

Other Names

• 2-Dodecylphenanthrene
• 2-n-Dodecylphenanthrene

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[422.89; 1054.52]	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			-8.89390e+01
Coefficient B			2.26852e+00
Coefficient C			-1.56116e-03
Coefficient D			4.36100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	422.89	J/mol×K	273.00	Calculated Property
Cp,gas	537.53	J/mol×K	353.78	Calculated Property
Cp,gas	637.84	J/mol×K	434.56	Calculated Property
Cp,gas	725.19	J/mol×K	515.33	Calculated Property
Cp,gas	800.97	J/mol×K	596.11	Calculated Property
Cp,gas	866.56	J/mol×K	676.89	Calculated Property
Cp,gas	923.32	J/mol×K	757.67	Calculated Property
Cp,gas	972.66	J/mol×K	838.44	Calculated Property
Cp,gas	1015.93	J/mol×K	919.22	Calculated Property
Cp,gas	1054.52	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0010828; 0.0002603]	Pa×s	[499.64; 757.10]	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			-1.10199e+01
Coefficient B			2.09438e+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.			499.64
Temperature range, max.			757.10
η	0.0010828	Pa×s	499.64	Calculated Property
η	0.0008629	Pa×s	528.25	Calculated Property
η	0.0007039	Pa×s	556.85	Calculated Property
η	0.0005857	Pa×s	585.46	Calculated Property
η	0.0004958	Pa×s	614.07	Calculated Property
η	0.0004260	Pa×s	642.67	Calculated Property
η	0.0003708	Pa×s	671.28	Calculated Property
η	0.0003264	Pa×s	699.89	Calculated Property
η	0.0002902	Pa×s	728.49	Calculated Property
η	0.0002603	Pa×s	757.10	Calculated Property

Similar Compounds

Find more compounds similar to Phenanthrene, 2-dodecyl-.

Sources

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

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