Chemical Properties of 9-(Chloromethyl)anthracene

InChI

InChI=1S/C15H11Cl/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9H,10H2

InChI Key

PCVRSXXPGXRVEZ-UHFFFAOYSA-N

Formula

C15H11Cl

SMILES

ClCc1c2ccccc2cc2ccccc12

Molecular Weight¹

226.71

Other Names

• 9-Chloromethyanthracene
• Anthracene, 9-(chloromethyl)-
• ICR 448
• 9-Chlormethyl-anthracen

• 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).
• 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, 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	[202.94; 495.29]	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			-6.60490e+01
Coefficient B			1.23030e+00
Coefficient C			-9.83160e-04
Coefficient D			3.14200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	202.94	J/mol×K	273.00	Calculated Property
Cp,gas	260.07	J/mol×K	353.78	Calculated Property
Cp,gas	308.71	J/mol×K	434.56	Calculated Property
Cp,gas	349.87	J/mol×K	515.33	Calculated Property
Cp,gas	384.54	J/mol×K	596.11	Calculated Property
Cp,gas	413.71	J/mol×K	676.89	Calculated Property
Cp,gas	438.38	J/mol×K	757.67	Calculated Property
Cp,gas	459.53	J/mol×K	838.44	Calculated Property
Cp,gas	478.17	J/mol×K	919.22	Calculated Property
Cp,gas	495.29	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0014783; 0.0004945]	Pa×s	[405.59; 634.82]	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			-9.54935e+00
Coefficient B			1.22994e+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.			405.59
Temperature range, max.			634.82
η	0.0014783	Pa×s	405.59	Calculated Property
η	0.0012358	Pa×s	431.06	Calculated Property
η	0.0010539	Pa×s	456.53	Calculated Property
η	0.0009141	Pa×s	482.00	Calculated Property
η	0.0008042	Pa×s	507.47	Calculated Property
η	0.0007162	Pa×s	532.94	Calculated Property
η	0.0006447	Pa×s	558.41	Calculated Property
η	0.0005856	Pa×s	583.88	Calculated Property
η	0.0005363	Pa×s	609.35	Calculated Property
η	0.0004945	Pa×s	634.82	Calculated Property

Similar Compounds

Find more compounds similar to 9-(Chloromethyl)anthracene.

Sources

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

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