Chemical Properties of Phenanthrene, 9-methyl-

InChI

InChI=1S/C15H12/c1-11-10-12-6-2-3-8-14(12)15-9-5-4-7-13(11)15/h2-10H,1H3

InChI Key

DALBHIYZSZZWBS-UHFFFAOYSA-N

Formula

C15H12

SMILES

Cc1cc2ccccc2c2ccccc12

Molecular Weight¹

192.26

Other Names

• 9-Methylphenanthrene

• 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).
• 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	0.4683		Relay (1.0) Calculated Property
ΔfG°	381.87	kJ/mol	Joback Calculated Property
ΔfH°gas	196.25	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	21.91	kJ/mol	Joback Calculated Property
ΔvapH°	85.15	kJ/mol	Relay (1.0) Calculated Property
IE	7.46 ± 0.03	eV	NIST
log10WS	-5.77		Relay (1.0) Calculated Property
logPoct/wat	4.301		Crippen Calculated Property
McVol	159.530	ml/mol	McGowan Calculated Property
Pc	2868.87	kPa	Joback Calculated Property
Inp	[319.17; 1959.00]
Inp	322.65		NIST
Inp	323.28		NIST
Inp	323.10		NIST
Inp	Outlier 1959.00		NIST
Inp	Outlier 1959.00		NIST
Inp	Outlier 1959.00		NIST
Inp	322.65		NIST
Inp	323.06		NIST
Inp	319.20		NIST
Inp	322.92		NIST
Inp	322.78		NIST
Inp	323.28		NIST
Inp	324.71		NIST
Inp	322.61		NIST
Inp	323.24		NIST
Inp	322.90		NIST
Inp	323.10		NIST
Inp	322.86		NIST
Inp	322.81		NIST
Inp	323.06		NIST
Inp	322.74		NIST
Inp	322.74		NIST
Inp	322.78		NIST
Inp	322.90		NIST
Inp	319.20		NIST
Inp	323.10		NIST
Inp	322.80		NIST
Inp	323.10		NIST
Inp	322.80		NIST
Inp	323.30		NIST
Inp	319.17		NIST
Inp	323.06		NIST
Inp	323.78		NIST
Inp	323.06		NIST
Inp	323.06		NIST
Tboil	621.87	K	Relay (1.0) Calculated Property
Tc	889.54	K	Relay (1.0) Calculated Property
Tfus	349.44	K	Relay (1.0) Calculated Property
Vc	0.606	m3/kmol	Relay (1.0) Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[189.54; 487.02]	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			-7.89400e+01
Coefficient B			1.22352e+00
Coefficient C			-9.62760e-04
Coefficient D			3.05200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	189.54	J/mol×K	273.00	Calculated Property
Cp,gas	246.93	J/mol×K	353.78	Calculated Property
Cp,gas	295.99	J/mol×K	434.56	Calculated Property
Cp,gas	337.67	J/mol×K	515.33	Calculated Property
Cp,gas	372.95	J/mol×K	596.11	Calculated Property
Cp,gas	402.78	J/mol×K	676.89	Calculated Property
Cp,gas	428.14	J/mol×K	757.67	Calculated Property
Cp,gas	449.99	J/mol×K	838.44	Calculated Property
Cp,gas	469.30	J/mol×K	919.22	Calculated Property
Cp,gas	487.02	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013574; 0.0004642]	Pa×s	[375.67; 606.64]	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			-9.42015e+00
Coefficient B			1.05862e+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.			375.67
Temperature range, max.			606.64
η	0.0013574	Pa×s	375.67	Calculated Property
η	0.0011336	Pa×s	401.33	Calculated Property
η	0.0009674	Pa×s	427.00	Calculated Property
η	0.0008405	Pa×s	452.66	Calculated Property
η	0.0007414	Pa×s	478.32	Calculated Property
η	0.0006624	Pa×s	503.99	Calculated Property
η	0.0005983	Pa×s	529.65	Calculated Property
η	0.0005455	Pa×s	555.32	Calculated Property
η	0.0005014	Pa×s	580.98	Calculated Property
η	0.0004642	Pa×s	606.64	Calculated Property

Similar Compounds

Find more compounds similar to Phenanthrene, 9-methyl-.

Sources

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

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