2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID Chemical Properties

Melting point:

45 - 50°C

Boiling point:

313.2±11.0 °C(Predicted)

Density 

1.027±0.06 g/cm3(Predicted)

storage temp. 

Refrigerator

solubility 

Chloroform (Slightly), Methanol (Slightly)

pka

4.41±0.10(Predicted)

form 

Solid

color 

White to Off-White

InChI

InChI=1S/C13H18O2/c1-4-9(2)11-5-7-12(8-6-11)10(3)13(14)15/h5-10H,4H2,1-3H3,(H,14,15)

InChIKey

OWMZINYEXURWLF-UHFFFAOYSA-N

SMILES

C(O)(=O)C(C1=CC=C(C(C)CC)C=C1)C

2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID Usage And Synthesis

Uses

2-(p-sec-Butylphenyl)propionic Acid (Ibuprofen EP Impurity O) is an impurity of Ibuprofen (I140000); a selective cyclooxygenase inhibitor (IC50=14.9uM) that inhibits PGH synthase-1 and PGH synthase-2 with comparable potency.

2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID(64451-76-9)Related Product Information

• 6-isobutyl-3-methyl-2,3-dihydro-1H-inden-1-one
• Ibuprofen
• Ibuprofen Related Compound C
• Ibuprofen Impurity 59
• (2RS)-2-(4-FORMYLPHENYL)PROPANOIC ACID
• rac a-Hydroxy Ibuprofen
• rac-Ibuprofen amide
• p-Isobutylstyrene
• 3-(4-ISOBUTYL-PHENYL)-PROPIONIC ACID
• Ibuprofen EP Impurity I
• (R)-(-)-IBUPROFEN
• 4-(2-Methylpropyl)benzeneethanol
• rac 2-Hydroxy Ibuprofen
• 4'-(2-Methylpropyl)acetophenone
• (2RS)-2-(4-BUTYLPHENYL)PROPANOIC ACID
• 2-(4-Methylphenyl)propanoic acid
• 2-[4-(2-Methylpropyl)phenyl] ethanol
• Ibuprofen Ethyl Ester