64451-76-9

Basic information

• Product Name: 2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID
• Synonyms: 2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID;IBUPROFEN IMPURITY O;IBuprofen Impurity 15;Ibuprofen EP Impurity O;2-(p-sec-Butylphenyl)propionic Acid;Imp. O (EP): 2-[4-(1-Methylpropyl)-phenyl]propanoic Acid
• CAS NO: 64451-76-9
• Molecular Formula: C₁₃H₁₈O₂
• Molecular Weight: 206.28
• Mol File: 64451-76-9.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 313.2±11.0 °C(Predicted)
• Appearance: /
• Density: 1.027±0.06 g/cm3(Predicted)
• Storage Temp.: Refrigerator
• Solubility: Chloroform (Slightly), Methanol (Slightly)
• PKA: 4.41±0.10(Predicted)
• CAS DataBase Reference: 2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID(64451-76-9)
• EPA Substance Registry System: 2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID(64451-76-9)

Safety Data

• Hazardous Substances Data: 64451-76-9(Hazardous Substances Data)

Usage

Description

2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID, also known as 2-(p-sec-Butylphenyl)propionic Acid, is an impurity of Ibuprofen (I140000). It is a selective cyclooxygenase inhibitor with an IC50 value of 14.9uM, which inhibits PGH synthase-1 and PGH synthase-2 with comparable potency.

Uses

Used in Pharmaceutical Industry:
2-[4-(1-METHYLPROPYL)PHENYL]PROPANOIC ACID is used as an impurity in the production of Ibuprofen, a widely used nonsteroidal anti-inflammatory drug (NSAID). It is utilized for its selective cyclooxygenase inhibitory properties, which contribute to the overall efficacy and safety of Ibuprofen as an anti-inflammatory and analgesic agent.

Downstream Products

• 153814-23-4 C₁₇H₂₄O₄