Chemical Properties of Benzeneacetic acid, 2-chloro- (CAS 2444-36-2)

InChI

InChI=1S/C8H7ClO2/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2,(H,10,11)

InChI Key

IUJAAIZKRJJZGQ-UHFFFAOYSA-N

Formula

C8H7ClO2

SMILES

O=C(O)Cc1ccccc1Cl

Molecular Weight¹

170.59

CAS

2444-36-2

Other Names

• (2-Chlorophenyl)acetic acid
• (2-chlorophenyl)ethanoic acid
• (o-Chlorophenyl)acetic acid
• 2-chlorobenzeneethanoic acid
• Acetic acid, (o-chlorophenyl)-
• o-chlorophenylacetic acid

• 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_fusH : Enthalpy of fusion at a given temperature (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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[260.19; 307.22]	J/mol×K	[597.24; 830.55]
Cp,gas	260.19	J/mol×K	597.24	Joback Calculated Property
Cp,gas	269.67	J/mol×K	636.13	Joback Calculated Property
Cp,gas	278.44	J/mol×K	675.01	Joback Calculated Property
Cp,gas	286.53	J/mol×K	713.90	Joback Calculated Property
Cp,gas	294.00	J/mol×K	752.78	Joback Calculated Property
Cp,gas	300.88	J/mol×K	791.67	Joback Calculated Property
Cp,gas	307.22	J/mol×K	830.55	Joback Calculated Property
η	[0.0002455; 0.0011293]	Pa×s	[409.38; 597.24]
η	0.0011293	Pa×s	409.38	Joback Calculated Property
η	0.0008001	Pa×s	440.69	Joback Calculated Property
η	0.0005933	Pa×s	472.00	Joback Calculated Property
η	0.0004567	Pa×s	503.31	Joback Calculated Property
η	0.0003624	Pa×s	534.62	Joback Calculated Property
η	0.0002951	Pa×s	565.93	Joback Calculated Property
η	0.0002455	Pa×s	597.24	Joback Calculated Property
ΔfusH	24.33	kJ/mol	367.40	NIST

Similar Compounds

Find more compounds similar to Benzeneacetic acid, 2-chloro-.

Mixtures

• Toluene + Benzeneacetic acid, 2-chloro-
• Water + Benzeneacetic acid, 2-chloro-
• Acetonitrile + Benzeneacetic acid, 2-chloro-
• Ethyl Acetate + Benzeneacetic acid, 2-chloro-
• Benzene, ethyl- + Benzeneacetic acid, 2-chloro-
• 1-Propanol + Benzeneacetic acid, 2-chloro-
• 2-Propanol + Benzeneacetic acid, 2-chloro-
• 1-Butanol + Benzeneacetic acid, 2-chloro-
• 1-Propanol, 2-methyl- + Benzeneacetic acid, 2-chloro-
• Cyclohexane + Benzeneacetic acid, 2-chloro-
• 2-Butanone + Benzeneacetic acid, 2-chloro-
• Acetone + Benzeneacetic acid, 2-chloro-

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Thermochemistry of phenylacetic and monochlorophenylacetic acids
• Solubility of 2-Chlorophenylacetic Acid in 12 Pure Solvents from T = (273.15/283.15 to 318.15) K: Determination and Modeling
• Joback Method
• McGowan Method
• NIST Webbook

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