Chemical Properties of Acenaphthene, 1-chloro

InChI

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

InChI Key

ANIXIIYQBGBGRI-UHFFFAOYSA-N

Formula

C12H9Cl

SMILES

ClC1Cc2cccc3cccc1c23

Molecular Weight¹

188.66

• 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_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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[161.75; 409.26]	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			-7.70000e+01
Coefficient B			1.10950e+00
Coefficient C			-9.49840e-04
Coefficient D			3.26600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	161.75	J/mol×K	273.00	Calculated Property
Cp,gas	211.10	J/mol×K	353.78	Calculated Property
Cp,gas	252.57	J/mol×K	434.56	Calculated Property
Cp,gas	287.21	J/mol×K	515.33	Calculated Property
Cp,gas	316.04	J/mol×K	596.11	Calculated Property
Cp,gas	340.10	J/mol×K	676.89	Calculated Property
Cp,gas	360.42	J/mol×K	757.67	Calculated Property
Cp,gas	378.03	J/mol×K	838.44	Calculated Property
Cp,gas	393.97	J/mol×K	919.22	Calculated Property
Cp,gas	409.26	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015704; 0.0009274]	Pa×s	[360.54; 570.59]	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			-7.88707e+00
Coefficient B			5.15810e+02
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.			360.54
Temperature range, max.			570.59
η	0.0015704	Pa×s	360.54	Calculated Property
η	0.0014396	Pa×s	383.88	Calculated Property
η	0.0013329	Pa×s	407.22	Calculated Property
η	0.0012444	Pa×s	430.56	Calculated Property
η	0.0011701	Pa×s	453.90	Calculated Property
η	0.0011068	Pa×s	477.23	Calculated Property
η	0.0010525	Pa×s	500.57	Calculated Property
η	0.0010052	Pa×s	523.91	Calculated Property
η	0.0009639	Pa×s	547.25	Calculated Property
η	0.0009274	Pa×s	570.59	Calculated Property

Similar Compounds

Find more compounds similar to Acenaphthene, 1-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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