Chemical Properties of Fluoranthene, 2-methyl- (CAS 33543-31-6)

InChI

InChI=1S/C17H12/c1-11-9-12-5-4-8-15-13-6-2-3-7-14(13)16(10-11)17(12)15/h2-10H,1H3

InChI Key

VVRCMNWZFPMXQZ-UHFFFAOYSA-N

Formula

C17H12

SMILES

Cc1cc2c3c(cccc3c1)-c1ccccc1-2

Molecular Weight¹

216.28

CAS

33543-31-6

Other Names

• 2-Methylfluoranthene

• 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).
• P_vap : Vapor 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	0.5426		Relay (1.0) Calculated Property
ΔfG°	489.97	kJ/mol	Joback Calculated Property
ΔfH°gas	250.32	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	26.70	kJ/mol	Joback Calculated Property
ΔvapH°	93.66	kJ/mol	Relay (1.0) Calculated Property
IE	7.64	eV	Relay (1.0) Calculated Property
log10WS	-6.76		Relay (1.0) Calculated Property
logPoct/wat	4.796		Crippen Calculated Property
McVol	172.550	ml/mol	McGowan Calculated Property
Pc	2726.86	kPa	Joback Calculated Property
Inp	[362.09; 362.09]
Inp	362.09		NIST
Inp	362.09		NIST
Tboil	670.41	K	Relay (1.0) Calculated Property
Tc	946.61	K	Relay (1.0) Calculated Property
Tfus	355.76	K	Relay (1.0) Calculated Property
Vc	0.684	m3/kmol	Relay (1.0) Calculated Property

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[435.75; 506.62]	J/mol×K	[679.22; 930.34]
Cp,gas	435.75	J/mol×K	679.22	Joback Calculated Property
Cp,gas	449.48	J/mol×K	721.07	Joback Calculated Property
Cp,gas	462.19	J/mol×K	762.93	Joback Calculated Property
Cp,gas	474.06	J/mol×K	804.78	Joback Calculated Property
Cp,gas	485.29	J/mol×K	846.63	Joback Calculated Property
Cp,gas	496.08	J/mol×K	888.49	Joback Calculated Property
Cp,gas	506.62	J/mol×K	930.34	Joback Calculated Property
η	[0.0013026; 0.0019946]	Pa×s	[449.71; 679.22]
η	0.0019946	Pa×s	449.71	Joback Calculated Property
η	0.0018069	Pa×s	487.96	Joback Calculated Property
η	0.0016605	Pa×s	526.21	Joback Calculated Property
η	0.0015435	Pa×s	564.47	Joback Calculated Property
η	0.0014482	Pa×s	602.72	Joback Calculated Property
η	0.0013691	Pa×s	640.97	Joback Calculated Property
η	0.0013026	Pa×s	679.22	Joback Calculated Property

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[503.76; 711.21]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.43521e+01
Coefficient B			-5.25038e+03
Coefficient C			-1.30454e+02
Temperature range, min.			503.76
Temperature range, max.			711.21
Pvap	1.33	kPa	503.76	Calculated Property
Pvap	3.02	kPa	526.81	Calculated Property
Pvap	6.26	kPa	549.86	Calculated Property
Pvap	12.01	kPa	572.91	Calculated Property
Pvap	21.61	kPa	595.96	Calculated Property
Pvap	36.80	kPa	619.01	Calculated Property
Pvap	59.72	kPa	642.06	Calculated Property
Pvap	92.95	kPa	665.11	Calculated Property
Pvap	139.48	kPa	688.16	Calculated Property
Pvap	202.66	kPa	711.21	Calculated Property

Similar Compounds

Find more compounds similar to Fluoranthene, 2-methyl-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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