Chemical Properties of 1H-Benzo[cd]fluoranthene

InChI

InChI=1S/C19H12/c1-2-7-15-14(6-1)16-10-8-12-4-3-5-13-9-11-17(15)19(16)18(12)13/h1-4,6-11H,5H2

InChI Key

ADWLGGYNRSSUMV-UHFFFAOYSA-N

Formula

C19H12

SMILES

C1=Cc2ccc3c4c(ccc(c24)C1)-c1ccccc1-3

Molecular Weight¹

240.31

• 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).
• 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 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	[222.57; 566.04]	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			-1.31360e+02
Coefficient B			1.67740e+00
Coefficient C			-1.55140e-03
Coefficient D			5.71400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	222.57	J/mol×K	273.00	Calculated Property
Cp,gas	293.20	J/mol×K	353.78	Calculated Property
Cp,gas	351.49	J/mol×K	434.56	Calculated Property
Cp,gas	399.26	J/mol×K	515.33	Calculated Property
Cp,gas	438.31	J/mol×K	596.11	Calculated Property
Cp,gas	470.45	J/mol×K	676.89	Calculated Property
Cp,gas	497.48	J/mol×K	757.67	Calculated Property
Cp,gas	521.22	J/mol×K	838.44	Calculated Property
Cp,gas	543.47	J/mol×K	919.22	Calculated Property
Cp,gas	566.04	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0038035; 0.0031635]	Pa×s	[507.71; 700.15]	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			-6.24209e+00
Coefficient B			3.40290e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			507.71
Temperature range, max.			700.15
η	0.0038035	Pa×s	507.71	Calculated Property
η	0.0037018	Pa×s	529.09	Calculated Property
η	0.0036105	Pa×s	550.47	Calculated Property
η	0.0035280	Pa×s	571.86	Calculated Property
η	0.0034531	Pa×s	593.24	Calculated Property
η	0.0033849	Pa×s	614.62	Calculated Property
η	0.0033225	Pa×s	636.00	Calculated Property
η	0.0032652	Pa×s	657.38	Calculated Property
η	0.0032123	Pa×s	678.76	Calculated Property
η	0.0031635	Pa×s	700.15	Calculated Property

Similar Compounds

Find more compounds similar to 1H-Benzo[cd]fluoranthene.

Sources

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

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