Chemical Properties of Acenaphthene, 5-chloro- (CAS 5209-33-6)

InChI

InChI=1S/C12H9Cl/c13-11-7-6-9-5-4-8-2-1-3-10(11)12(8)9/h1-3,6-7H,4-5H2

InChI Key

XIDFXORSALFWOP-UHFFFAOYSA-N

Formula

C12H9Cl

SMILES

Clc1ccc2c3c(cccc13)CC2

Molecular Weight¹

188.65

CAS

5209-33-6

• 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).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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.

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboilr	[436.20; 592.20]	K	[1.70; 103.00]
Tboilr	436.20	K	1.70	NIST
Tboilr	592.20	K	103.00	NIST

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[162.03; 399.56]	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			-6.86400e+01
Coefficient B			1.07650e+00
Coefficient C			-9.38200e-04
Coefficient D			3.29900e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	162.03	J/mol×K	273.00	Calculated Property
Cp,gas	209.39	J/mol×K	353.78	Calculated Property
Cp,gas	249.06	J/mol×K	434.56	Calculated Property
Cp,gas	282.11	J/mol×K	515.33	Calculated Property
Cp,gas	309.57	J/mol×K	596.11	Calculated Property
Cp,gas	332.48	J/mol×K	676.89	Calculated Property
Cp,gas	351.89	J/mol×K	757.67	Calculated Property
Cp,gas	368.85	J/mol×K	838.44	Calculated Property
Cp,gas	384.39	J/mol×K	919.22	Calculated Property
Cp,gas	399.56	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0016055; 0.0008335]	Pa×s	[377.30; 578.05]	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			-8.32207e+00
Coefficient B			7.12240e+02
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			377.30
Temperature range, max.			578.05
η	0.0016055	Pa×s	377.30	Calculated Property
η	0.0014449	Pa×s	399.61	Calculated Property
η	0.0013150	Pa×s	421.91	Calculated Property
η	0.0012081	Pa×s	444.22	Calculated Property
η	0.0011189	Pa×s	466.52	Calculated Property
η	0.0010436	Pa×s	488.83	Calculated Property
η	0.0009793	Pa×s	511.14	Calculated Property
η	0.0009239	Pa×s	533.44	Calculated Property
η	0.0008757	Pa×s	555.75	Calculated Property
η	0.0008335	Pa×s	578.05	Calculated Property

Similar Compounds

Find more compounds similar to Acenaphthene, 5-chloro-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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