Cas no 1195945-01-7 (3-fluoro-5-hydroxy-4-methoxybenzoic acid)

3-Fluoro-5-hydroxy-4-methoxybenzoic acid is a fluorinated benzoic acid derivative characterized by its distinct substitution pattern, which includes hydroxyl, methoxy, and fluoro functional groups. This compound is of interest in synthetic organic chemistry and pharmaceutical research due to its potential as a versatile intermediate. The presence of both electron-donating (hydroxy, methoxy) and electron-withdrawing (fluoro) groups enhances its reactivity in electrophilic and nucleophilic transformations. Its structural features make it suitable for applications in medicinal chemistry, particularly in the design of bioactive molecules. The compound exhibits moderate solubility in polar organic solvents, facilitating its use in various synthetic protocols. Careful handling is advised due to potential sensitivity to light and moisture.
3-fluoro-5-hydroxy-4-methoxybenzoic acid structure
1195945-01-7 structure
Product Name:3-fluoro-5-hydroxy-4-methoxybenzoic acid
CAS No:1195945-01-7
MF:C8H7FO4
MW:186.137186288834
CID:838706
Update Time:2026-04-29

3-fluoro-5-hydroxy-4-methoxybenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-fluoro-5-hydroxy-4-methoxybenzoic acid
    • Inchi: InChI=1S/C8H7FO4/c1-13-7-5(9)2-4(8(11)12)3-6(7)10/h2-3,10H,1H3,(H,11,12)
    • InChI Key: XDYLTVLFCIIHNX-UHFFFAOYSA-N
    • SMILES: COC1=C(C=C(C=C1O)C(=O)O)F

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2

Experimental Properties

  • Density: 1.447
  • Boiling Point: 357 oC
  • Flash Point: 170 oC

3-fluoro-5-hydroxy-4-methoxybenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1559933-10g
3-Fluoro-5-hydroxy-4-methoxybenzoic acid
1195945-01-7 98%
10g
¥24560.00 2024-08-09
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