Chemical Properties of 2,4,5-trichlorotoluene

InChI

InChI=1S/C7H5Cl3/c1-4-2-6(9)7(10)3-5(4)8/h2-3H,1H3

InChI Key

ZCXHZKNWIYVQNC-UHFFFAOYSA-N

Formula

C7H5Cl3

SMILES

Cc1cc(Cl)c(Cl)cc1Cl

Molecular Weight¹

195.48

Other Names

• Benzene, 1,2,4-trichloro-5-methyl-
• Benzene, 1-methyl-2,4,5-trichloro-
• Toluene, 2,4,5-trichloro-

• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_boilr : Boiling point at reduced pressure (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, 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

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[144.59; 277.63]	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			4.41900e+01
Coefficient B			4.31820e-01
Coefficient C			-2.48280e-04
Coefficient D			4.99000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	144.59	J/mol×K	273.00	Calculated Property
Cp,gas	168.09	J/mol×K	353.78	Calculated Property
Cp,gas	189.05	J/mol×K	434.56	Calculated Property
Cp,gas	207.62	J/mol×K	515.33	Calculated Property
Cp,gas	223.95	J/mol×K	596.11	Calculated Property
Cp,gas	238.20	J/mol×K	676.89	Calculated Property
Cp,gas	250.54	J/mol×K	757.67	Calculated Property
Cp,gas	261.12	J/mol×K	838.44	Calculated Property
Cp,gas	270.10	J/mol×K	919.22	Calculated Property
Cp,gas	277.63	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0009032; 0.0002620]	Pa×s	[355.55; 525.06]	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			-1.08436e+01
Coefficient B			1.36316e+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.			355.55
Temperature range, max.			525.06
η	0.0009032	Pa×s	355.55	Calculated Property
η	0.0007447	Pa×s	374.38	Calculated Property
η	0.0006255	Pa×s	393.22	Calculated Property
η	0.0005339	Pa×s	412.05	Calculated Property
η	0.0004620	Pa×s	430.89	Calculated Property
η	0.0004047	Pa×s	449.72	Calculated Property
η	0.0003583	Pa×s	468.55	Calculated Property
η	0.0003202	Pa×s	487.39	Calculated Property
η	0.0002885	Pa×s	506.22	Calculated Property
η	0.0002620	Pa×s	525.06	Calculated Property

Similar Compounds

Find more compounds similar to 2,4,5-trichlorotoluene.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• 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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