Cas no 1250330-26-7 (5-Pyrimidinecarboxylic acid, 4-ethyl-2-(2-methylpropyl)-)

5-Pyrimidinecarboxylic acid, 4-ethyl-2-(2-methylpropyl)-, is a specialized heterocyclic compound featuring a pyrimidine core substituted with an ethyl group at the 4-position and a 2-methylpropyl group at the 2-position, along with a carboxylic acid functionality. This structure imparts versatility in synthetic applications, particularly in pharmaceutical and agrochemical research, where it may serve as a key intermediate for the development of bioactive molecules. The presence of both alkyl and carboxyl groups enhances its reactivity, enabling further derivatization. Its well-defined molecular architecture ensures consistent performance in coupling reactions and other transformations, making it a valuable building block for advanced chemical synthesis.
5-Pyrimidinecarboxylic acid, 4-ethyl-2-(2-methylpropyl)- structure
1250330-26-7 structure
Product Name:5-Pyrimidinecarboxylic acid, 4-ethyl-2-(2-methylpropyl)-
CAS No:1250330-26-7
MF:C11H16N2O2
MW:208.256942749023
CID:5272824
Update Time:2025-05-22

5-Pyrimidinecarboxylic acid, 4-ethyl-2-(2-methylpropyl)- Chemical and Physical Properties

Names and Identifiers

    • 4-Ethyl-2-isobutylpyrimidine-5-carboxylic acid
    • 4-ethyl-2-(2-methylpropyl)pyrimidine-5-carboxylic acid
    • 5-Pyrimidinecarboxylic acid, 4-ethyl-2-(2-methylpropyl)-
    • Inchi: 1S/C11H16N2O2/c1-4-9-8(11(14)15)6-12-10(13-9)5-7(2)3/h6-7H,4-5H2,1-3H3,(H,14,15)
    • InChI Key: PDVFCPBBDFTOKG-UHFFFAOYSA-N
    • SMILES: OC(C1C=NC(CC(C)C)=NC=1CC)=O

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 219
  • XLogP3: 2.2
  • Topological Polar Surface Area: 63.1

5-Pyrimidinecarboxylic acid, 4-ethyl-2-(2-methylpropyl)- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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