Chemical Properties of chlorotoluene (CAS 25168-05-2)

InChI

InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3

InChI Key

IBSQPLPBRSHTTG-UHFFFAOYSA-N

Formula

C7H7Cl

SMILES

Cc1ccccc1Cl

Molecular Weight¹

126.58

CAS

25168-05-2

Other Names

• Benzyl chloride

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[112.68; 267.17]	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			-1.01900e+01
Coefficient B			5.37220e-01
Coefficient C			-3.41560e-04
Coefficient D			8.17000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	112.68	J/mol×K	273.00	Calculated Property
Cp,gas	140.73	J/mol×K	353.78	Calculated Property
Cp,gas	165.47	J/mol×K	434.56	Calculated Property
Cp,gas	187.13	J/mol×K	515.33	Calculated Property
Cp,gas	205.99	J/mol×K	596.11	Calculated Property
Cp,gas	222.29	J/mol×K	676.89	Calculated Property
Cp,gas	236.30	J/mol×K	757.67	Calculated Property
Cp,gas	248.28	J/mol×K	838.44	Calculated Property
Cp,gas	258.48	J/mol×K	919.22	Calculated Property
Cp,gas	267.17	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0021341; 0.0002225]	Pa×s	[237.51; 455.12]	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			-1.08781e+01
Coefficient B			1.12304e+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.			237.51
Temperature range, max.			455.12
η	0.0021341	Pa×s	237.51	Calculated Property
η	0.0013788	Pa×s	261.69	Calculated Property
η	0.0009591	Pa×s	285.87	Calculated Property
η	0.0007060	Pa×s	310.05	Calculated Property
η	0.0005432	Pa×s	334.23	Calculated Property
η	0.0004331	Pa×s	358.40	Calculated Property
η	0.0003553	Pa×s	382.58	Calculated Property
η	0.0002984	Pa×s	406.76	Calculated Property
η	0.0002556	Pa×s	430.94	Calculated Property
η	0.0002225	Pa×s	455.12	Calculated Property

Similar Compounds

Find more compounds similar to chlorotoluene.

Sources

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

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