Cas no 1563531-47-4 (4-Bromo-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazole)

4-Bromo-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazole is a heterocyclic compound featuring a pyrazole core substituted with a bromo group at the 4-position and a methyl group at the 3-position. The tetrahydro-2H-pyran-4-yl moiety at the 1-position enhances its steric and electronic properties, making it a valuable intermediate in organic synthesis and medicinal chemistry. This compound is particularly useful in the development of pharmacologically active molecules due to its structural versatility and reactivity. Its well-defined molecular structure allows for precise modifications, facilitating applications in drug discovery and agrochemical research. High purity and stability under standard conditions further underscore its utility in synthetic workflows.
4-Bromo-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazole structure
1563531-47-4 structure
Product Name:4-Bromo-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazole
CAS No:1563531-47-4
MF:C9H13BrN2O
MW:245.116321325302
MDL:MFCD22381940
CID:4701983
Update Time:2025-06-07

4-Bromo-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazole Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazole
    • 4-Bromo-3-methyl-1-(oxan-4-yl)-1h-pyrazole
    • MDL: MFCD22381940
    • Inchi: 1S/C9H13BrN2O/c1-7-9(10)6-12(11-7)8-2-4-13-5-3-8/h6,8H,2-5H2,1H3
    • InChI Key: WFWOJNRIRMVBOG-UHFFFAOYSA-N
    • SMILES: BrC1C(C)=NN(C=1)C1CCOCC1

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 173
  • Topological Polar Surface Area: 27

4-Bromo-3-methyl-1-(tetrahydro-2H-pyran-4-yl)-1H-pyrazole Pricemore >>

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