Chemical Properties of Phenol, 2,6-dichloro-4-(1-methylpropyl)- (CAS 34593-74-3)

InChI

InChI=1S/C10H12Cl2O/c1-3-6(2)7-4-8(11)10(13)9(12)5-7/h4-6,13H,3H2,1-2H3

InChI Key

DZKJAGRVOGNQGW-UHFFFAOYSA-N

Formula

C10H12Cl2O

SMILES

CCC(C)c1cc(Cl)c(O)c(Cl)c1

Molecular Weight¹

219.11

CAS

34593-74-3

Other Names

• 4-Sec-butyl-2,6-dichlorophenol

• ω : Acentric Factor.
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation 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	[208.85; 450.13]	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			3.67100e+00
Coefficient B			9.30040e-01
Coefficient C			-7.17680e-04
Coefficient D			2.34100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	208.85	J/mol×K	273.00	Calculated Property
Cp,gas	253.24	J/mol×K	353.78	Calculated Property
Cp,gas	291.51	J/mol×K	434.56	Calculated Property
Cp,gas	324.40	J/mol×K	515.33	Calculated Property
Cp,gas	352.64	J/mol×K	596.11	Calculated Property
Cp,gas	376.98	J/mol×K	676.89	Calculated Property
Cp,gas	398.16	J/mol×K	757.67	Calculated Property
Cp,gas	416.92	J/mol×K	838.44	Calculated Property
Cp,gas	434.00	J/mol×K	919.22	Calculated Property
Cp,gas	450.13	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008848; 0.0000396]	Pa×s	[410.48; 597.41]	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			-1.69604e+01
Coefficient B			4.07618e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			410.48
Temperature range, max.			597.41
η	0.0008848	Pa×s	410.48	Calculated Property
η	0.0005485	Pa×s	431.25	Calculated Property
η	0.0003552	Pa×s	452.02	Calculated Property
η	0.0002390	Pa×s	472.79	Calculated Property
η	0.0001663	Pa×s	493.56	Calculated Property
η	0.0001191	Pa×s	514.33	Calculated Property
η	0.0000876	Pa×s	535.10	Calculated Property
η	0.0000659	Pa×s	555.87	Calculated Property
η	0.0000506	Pa×s	576.64	Calculated Property
η	0.0000396	Pa×s	597.41	Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 2,6-dichloro-4-(1-methylpropyl)-.

Sources

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

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