Chemical Properties of [2H8]-2,3-dichloro-1,4-dimethylbenzene

InChI

InChI=1S/C8H8Cl2/c1-5-3-4-6(2)8(10)7(5)9/h3-4H,1-2H3/i1D3,2D3,3D,4D

InChI Key

UGHIQYNKFXEQPU-PIODKIDGSA-N

Formula

C8H8Cl2

SMILES

[2H]c1c([2H])c(C([2H])([2H])[2H])c(Cl)c(Cl)c1C([2H])([2H])[2H]

Molecular Weight¹

183.11

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	17.74	kJ/mol	Joback Calculated Property
logPoct/wat	3.610		Crippen Calculated Property
McVol	124.300	ml/mol	McGowan Calculated Property
Inp	[1231.00; 1267.00]
Inp	1267.00		NIST
Inp	1231.00		NIST
Inp	1267.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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	[152.40; 320.95]	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			3.03900e+01
Coefficient B			5.20040e-01
Coefficient C			-2.82280e-04
Coefficient D			5.28000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	152.40	J/mol×K	273.00	Calculated Property
Cp,gas	181.38	J/mol×K	353.78	Calculated Property
Cp,gas	207.40	J/mol×K	434.56	Calculated Property
Cp,gas	230.65	J/mol×K	515.33	Calculated Property
Cp,gas	251.27	J/mol×K	596.11	Calculated Property
Cp,gas	269.44	J/mol×K	676.89	Calculated Property
Cp,gas	285.33	J/mol×K	757.67	Calculated Property
Cp,gas	299.10	J/mol×K	838.44	Calculated Property
Cp,gas	310.91	J/mol×K	919.22	Calculated Property
Cp,gas	320.95	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0013878; 0.0002526]	Pa×s	[303.74; 508.25]	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			-1.08139e+01
Coefficient B			1.28600e+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.			303.74
Temperature range, max.			508.25
η	0.0013878	Pa×s	303.74	Calculated Property
η	0.0010336	Pa×s	326.46	Calculated Property
η	0.0007998	Pa×s	349.19	Calculated Property
η	0.0006387	Pa×s	371.91	Calculated Property
η	0.0005234	Pa×s	394.63	Calculated Property
η	0.0004383	Pa×s	417.36	Calculated Property
η	0.0003738	Pa×s	440.08	Calculated Property
η	0.0003239	Pa×s	462.81	Calculated Property
η	0.0002844	Pa×s	485.53	Calculated Property
η	0.0002526	Pa×s	508.25	Calculated Property

Similar Compounds

Find more compounds similar to [2H8]-2,3-dichloro-1,4-dimethylbenzene.

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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