Chemical Properties of 9-n-propylphenanthrene

InChI

InChI=1S/C17H16/c1-2-7-13-12-14-8-3-4-9-16(14)17-11-6-5-10-15(13)17/h3-6,8-12H,2,7H2,1H3

InChI Key

PIWHTUVAMGYSIC-UHFFFAOYSA-N

Formula

C17H16

SMILES

CCCc1cc2ccccc2c2ccccc12

Molecular Weight¹

220.32

Other Names

• Phenanthrene, 9-propyl-

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• I_np : Non-polar retention indices.
• 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

Property	Value	Unit	Source
ω	0.5484		Relay (1.0) Calculated Property
ΔfH°gas	152.98	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	27.09	kJ/mol	Joback Calculated Property
ΔvapH°	90.65	kJ/mol	Relay (1.0) Calculated Property
IE	7.73	eV	Relay (1.0) Calculated Property
log10WS	-6.46		Relay (1.0) Calculated Property
logPoct/wat	4.946		Crippen Calculated Property
McVol	187.710	ml/mol	McGowan Calculated Property
Pc	2358.78	kPa	Joback Calculated Property
Inp	[350.30; 350.30]
Inp	350.30		NIST
Inp	350.30		NIST
Inp	350.30		NIST
Tboil	646.54	K	Relay (1.0) Calculated Property
Tc	892.14	K	Relay (1.0) Calculated Property
Tfus	332.88	K	Relay (1.0) Calculated Property
Vc	0.708	m3/kmol	Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[231.96; 590.20]	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			-8.07580e+01
Coefficient B			1.41352e+00
Coefficient C			-1.07156e-03
Coefficient D			3.29000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	231.96	J/mol×K	273.00	Calculated Property
Cp,gas	299.77	J/mol×K	353.78	Calculated Property
Cp,gas	358.14	J/mol×K	434.56	Calculated Property
Cp,gas	408.13	J/mol×K	515.33	Calculated Property
Cp,gas	450.77	J/mol×K	596.11	Calculated Property
Cp,gas	487.11	J/mol×K	676.89	Calculated Property
Cp,gas	518.18	J/mol×K	757.67	Calculated Property
Cp,gas	545.02	J/mol×K	838.44	Calculated Property
Cp,gas	568.68	J/mol×K	919.22	Calculated Property
Cp,gas	590.20	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014293; 0.0004499]	Pa×s	[398.21; 631.23]	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			-9.68194e+00
Coefficient B			1.24694e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			398.21
Temperature range, max.			631.23
η	0.0014293	Pa×s	398.21	Calculated Property
η	0.0011806	Pa×s	424.10	Calculated Property
η	0.0009968	Pa×s	449.99	Calculated Property
η	0.0008573	Pa×s	475.88	Calculated Property
η	0.0007489	Pa×s	501.77	Calculated Property
η	0.0006629	Pa×s	527.66	Calculated Property
η	0.0005936	Pa×s	553.56	Calculated Property
η	0.0005367	Pa×s	579.45	Calculated Property
η	0.0004895	Pa×s	605.34	Calculated Property
η	0.0004499	Pa×s	631.23	Calculated Property

Similar Compounds

Find more compounds similar to 9-n-propylphenanthrene.

Sources

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

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