Chemical Properties of Benzenemethanol, 3,4-dichloro-«alpha»-methyl- (CAS 1475-11-2)

InChI

InChI=1S/C8H8Cl2O/c1-5(11)6-2-3-7(9)8(10)4-6/h2-5,11H,1H3

InChI Key

VZTGSONNNMGQNQ-UHFFFAOYSA-N

Formula

C8H8Cl2O

SMILES

CC(O)c1ccc(Cl)c(Cl)c1

Molecular Weight¹

191.06

CAS

1475-11-2

Other Names

• 1-(3,4-Dichlorophenyl)ethanol
• 3,4-Dichloro-«alpha»-methylbenzyl alcohol
• 3,4-Dichlorophenyl methyl carbinol
• Benzyl alcohol, 3,4-dichloro-«alpha»-methyl-

• 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_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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[162.03; 343.20]	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			1.97000e+01
Coefficient B			6.19420e-01
Coefficient C			-3.82920e-04
Coefficient D			8.70000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	162.03	J/mol×K	273.00	Calculated Property
Cp,gas	194.76	J/mol×K	353.78	Calculated Property
Cp,gas	223.70	J/mol×K	434.56	Calculated Property
Cp,gas	249.12	J/mol×K	515.33	Calculated Property
Cp,gas	271.30	J/mol×K	596.11	Calculated Property
Cp,gas	290.51	J/mol×K	676.89	Calculated Property
Cp,gas	307.04	J/mol×K	757.67	Calculated Property
Cp,gas	321.14	J/mol×K	838.44	Calculated Property
Cp,gas	333.10	J/mol×K	919.22	Calculated Property
Cp,gas	343.20	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0047267; 0.0001228]	Pa×s	[337.04; 559.46]	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			-1.45364e+01
Coefficient B			3.09467e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			337.04
Temperature range, max.			559.46
η	0.0047267	Pa×s	337.04	Calculated Property
η	0.0025243	Pa×s	361.75	Calculated Property
η	0.0014607	Pa×s	386.47	Calculated Property
η	0.0009027	Pa×s	411.18	Calculated Property
η	0.0005891	Pa×s	435.89	Calculated Property
η	0.0004025	Pa×s	460.61	Calculated Property
η	0.0002859	Pa×s	485.32	Calculated Property
η	0.0002099	Pa×s	510.04	Calculated Property
η	0.0001586	Pa×s	534.75	Calculated Property
η	0.0001228	Pa×s	559.46	Calculated Property

Similar Compounds

Find more compounds similar to Benzenemethanol, 3,4-dichloro-«alpha»-methyl-.

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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