Chemical Properties of 4-Bromo-o-toloxy acetic acid (CAS 25477-00-3)

InChI

InChI=1S/C9H9BrO3/c1-6-2-3-7(10)4-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)

InChI Key

KQQHLMBLDZPBCO-UHFFFAOYSA-N

Formula

C9H9BrO3

SMILES

Cc1ccc(Br)cc1OCC(=O)O

Molecular Weight¹

245.07

CAS

25477-00-3

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[332.69; 378.28]	J/mol×K	[676.59; 891.07]
Cp,gas	332.69	J/mol×K	676.59	Joback Calculated Property
Cp,gas	341.68	J/mol×K	712.34	Joback Calculated Property
Cp,gas	350.09	J/mol×K	748.08	Joback Calculated Property
Cp,gas	357.94	J/mol×K	783.83	Joback Calculated Property
Cp,gas	365.25	J/mol×K	819.58	Joback Calculated Property
Cp,gas	372.02	J/mol×K	855.32	Joback Calculated Property
Cp,gas	378.28	J/mol×K	891.07	Joback Calculated Property
η	[0.0000611; 0.0010385]	Pa×s	[435.43; 676.59]
η	0.0010385	Pa×s	435.43	Joback Calculated Property
η	0.0005305	Pa×s	475.62	Joback Calculated Property
η	0.0003009	Pa×s	515.82	Joback Calculated Property
η	0.0001852	Pa×s	556.01	Joback Calculated Property
η	0.0001217	Pa×s	596.20	Joback Calculated Property
η	0.0000844	Pa×s	636.40	Joback Calculated Property
η	0.0000611	Pa×s	676.59	Joback Calculated Property

Similar Compounds

Find more compounds similar to 4-Bromo-o-toloxy acetic acid.

Sources

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

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