Chemical Properties of p-Chlorophenylacetyl chloride (CAS 25026-34-0)

InChI

InChI=1S/C8H6Cl2O/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2

InChI Key

UMQUIRYNOVNYPA-UHFFFAOYSA-N

Formula

C8H6Cl2O

SMILES

O=C(Cl)Cc1ccc(Cl)cc1

Molecular Weight¹

189.04

CAS

25026-34-0

Other Names

• 4-Chlorophenacyl chloride
• 4-Chlorophenylacetyl chloride
• Benzeneacetyl chloride, 4-chloro-

• 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_boilr : Boiling point at reduced pressure (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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[148.22; 316.05]	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			9.15100e+00
Coefficient B			6.11000e-01
Coefficient C			-3.97660e-04
Coefficient D			9.35600e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	148.22	J/mol×K	273.00	Calculated Property
Cp,gas	179.68	J/mol×K	353.78	Calculated Property
Cp,gas	207.25	J/mol×K	434.56	Calculated Property
Cp,gas	231.22	J/mol×K	515.33	Calculated Property
Cp,gas	251.89	J/mol×K	596.11	Calculated Property
Cp,gas	269.55	J/mol×K	676.89	Calculated Property
Cp,gas	284.50	J/mol×K	757.67	Calculated Property
Cp,gas	297.04	J/mol×K	838.44	Calculated Property
Cp,gas	307.45	J/mol×K	919.22	Calculated Property
Cp,gas	316.05	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0021405; 0.0002990]	Pa×s	[328.63; 543.79]	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			-1.11210e+01
Coefficient B			1.63471e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			328.63
Temperature range, max.			543.79
η	0.0021405	Pa×s	328.63	Calculated Property
η	0.0015276	Pa×s	352.54	Calculated Property
η	0.0011380	Pa×s	376.44	Calculated Property
η	0.0008780	Pa×s	400.35	Calculated Property
η	0.0006976	Pa×s	424.26	Calculated Property
η	0.0005680	Pa×s	448.16	Calculated Property
η	0.0004722	Pa×s	472.07	Calculated Property
η	0.0003996	Pa×s	495.98	Calculated Property
η	0.0003434	Pa×s	519.88	Calculated Property
η	0.0002990	Pa×s	543.79	Calculated Property

Similar Compounds

Find more compounds similar to p-Chlorophenylacetyl chloride.

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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