Chemical Properties of 3,4-Dichlorobenzyl alcohol (CAS 1805-32-9)

InChI

InChI=1S/C7H6Cl2O/c8-6-2-1-5(4-10)3-7(6)9/h1-3,10H,4H2

InChI Key

FVJIUQSKXOYFKG-UHFFFAOYSA-N

Formula

C7H6Cl2O

SMILES

OCc1ccc(Cl)c(Cl)c1

Molecular Weight¹

177.03

CAS

1805-32-9

Other Names

• Benzenemethanol, 3,4-dichloro-
• Benzyl alcohol, 3,4-dichloro-

• 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_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 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	[141.13; 291.07]	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			2.22910e+01
Coefficient B			5.18500e-01
Coefficient C			-3.25320e-04
Coefficient D			7.56000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	141.13	J/mol×K	273.00	Calculated Property
Cp,gas	168.36	J/mol×K	353.78	Calculated Property
Cp,gas	192.38	J/mol×K	434.56	Calculated Property
Cp,gas	213.44	J/mol×K	515.33	Calculated Property
Cp,gas	231.79	J/mol×K	596.11	Calculated Property
Cp,gas	247.65	J/mol×K	676.89	Calculated Property
Cp,gas	261.27	J/mol×K	757.67	Calculated Property
Cp,gas	272.89	J/mol×K	838.44	Calculated Property
Cp,gas	282.74	J/mol×K	919.22	Calculated Property
Cp,gas	291.07	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0037516; 0.0001471]	Pa×s	[340.77; 543.11]	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			-1.42797e+01
Coefficient B			2.96269e+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.			340.77
Temperature range, max.			543.11
η	0.0037516	Pa×s	340.77	Calculated Property
η	0.0021904	Pa×s	363.25	Calculated Property
η	0.0013617	Pa×s	385.73	Calculated Property
η	0.0008920	Pa×s	408.22	Calculated Property
η	0.0006107	Pa×s	430.70	Calculated Property
η	0.0004341	Pa×s	453.18	Calculated Property
η	0.0003187	Pa×s	475.66	Calculated Property
η	0.0002406	Pa×s	498.14	Calculated Property
η	0.0001861	Pa×s	520.63	Calculated Property
η	0.0001471	Pa×s	543.11	Calculated Property

Similar Compounds

Find more compounds similar to 3,4-Dichlorobenzyl alcohol.

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
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