Chemical Properties of Flurbiprofen (CAS 5104-49-4)

InChI

InChI=1S/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)

InChI Key

SYTBZMRGLBWNTM-UHFFFAOYSA-N

Formula

C15H13FO2

SMILES

CC(C(=O)O)c1ccc(-c2ccccc2)c(F)c1

Molecular Weight¹

244.26

CAS

5104-49-4

Other Names

• (.+/-.)-2-(2-Fluoro-4-biphenylyl)propionic acid
• (.+/-.)-2-Fluoro-«alpha»-methyl-4-biphenylacetic acid
• (.+/-.)-2-Fluoro-«alpha»-methyl-4-biphenylacetic acid
• (.+/-.)-Flurbiprofen
• 2-(2-Fluoro-4-biphenylyl)propionic acid
• 2-(2-fluoro-4-biphenyl)propionic acid
• 2-(2-fluoro-4-biphenylyl)propanoic acid
• 2-Fluoro-«alpha»-methyl(1,1'-biphenyl)-4-acetic acid
• 2-Fluoro-«alpha»-methyl-4-biphenylacetic acid
• 2-Fluoro-«alpha»-methyl[1,1'-biphenyl]-4-acetic acid (flurbiprofen)
• 2-Fluoro-«alpha»-methyl(1,1'-biphenyl)-4-acetic acid
• 2-Fluoro-«alpha»-methyl-4-biphenylacetic acid
• 2-Fluoro-«alpha»-methyl[1,1'-biphenyl]-4-acetic acid (flurbiprofen)
• 3-Fluoro-4-phenylhydratropic acid
• 4-Biphenylacetic acid, 2-fluoro-«alpha»-methyl-
• 4-Biphenylacetic acid, 2-fluoro-«alpha»-methyl-
• 4-biphenylacetic acid, 2-fluoro-.alpha.-methyl-
• Adfeed
• Ansaid
• Antadys
• BTS 18322
• Cebutid
• FP 70
• Flurofen
• Froben
• Stayban
• U-27182
• Zepolas
• [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-«alpha»-methyl-
• [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-«alpha»-methyl-, (.+/-.)-
• [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-«alpha»-methyl-
• [1,1'-Biphenyl]-4-acetic acid, 2-fluoro-«alpha»-methyl-, (.+/-.)-
• [1,1'-biphenyl]-4-acetic acid, 2-fluoro-.alpha.-methyl-
• dl-Flurbiprofen
• hydratropic acid, 3-fluoro-4-phenyl-

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_subH : Enthalpy of sublimation at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• 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	[499.82; 559.20]	J/mol×K	[750.80; 969.56]
Cp,gas	499.82	J/mol×K	750.80	Joback Calculated Property
Cp,gas	511.81	J/mol×K	787.26	Joback Calculated Property
Cp,gas	522.89	J/mol×K	823.72	Joback Calculated Property
Cp,gas	533.12	J/mol×K	860.18	Joback Calculated Property
Cp,gas	542.55	J/mol×K	896.64	Joback Calculated Property
Cp,gas	551.23	J/mol×K	933.10	Joback Calculated Property
Cp,gas	559.20	J/mol×K	969.56	Joback Calculated Property
ΔfusH	27.90	kJ/mol	386.70	NIST
ΔsubH	108.40 ± 0.50	kJ/mol	354.50	NIST

Similar Compounds

Find more compounds similar to Flurbiprofen.

Mixtures

• Carbon dioxide + Flurbiprofen
• Carbon dioxide + Ethanol + Flurbiprofen
• Carbon dioxide + Methyl Alcohol + Flurbiprofen

Sources

• Crippen Method
• Solubility of Flurbiprofen in Supercritical Carbon Dioxide
• Solubility of Flurbiprofen in CO2 and CO2 + Methanol
• Joback Method
• Aqueous Solubility Prediction Method
• McGowan Method
• NIST Webbook

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