Cas no 1261980-64-6 (3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid)

3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid is a fluorinated benzoic acid derivative featuring a dimethoxyphenyl substituent, which enhances its utility in synthetic organic chemistry and pharmaceutical research. The presence of both electron-donating methoxy groups and an electron-withdrawing fluorine atom on the aromatic ring system imparts unique electronic properties, making it a valuable intermediate for designing complex molecules. Its structural features facilitate applications in medicinal chemistry, particularly in the development of bioactive compounds. The compound's high purity and well-defined reactivity profile ensure consistent performance in coupling reactions and other transformations. Its stability under standard laboratory conditions further supports its use in multi-step synthetic routes.
3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid structure
1261980-64-6 structure
Product Name:3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid
CAS No:1261980-64-6
MF:C15H13FO4
MW:276.259728193283
MDL:MFCD18321351
CID:2621554
PubChem ID:53227234
Update Time:2025-05-28

3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid, 95%
    • DTXSID20690821
    • 1261980-64-6
    • 6-Fluoro-2',5'-dimethoxy[1,1'-biphenyl]-3-carboxylic acid
    • 3-(2,5-DIMETHOXYPHENYL)-4-FLUOROBENZOIC ACID
    • MFCD18321351
    • 3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid
    • MDL： MFCD18321351
    • Inchi： 1S/C15H13FO4/c1-19-10-4-6-14(20-2)12(8-10)11-7-9(15(17)18)3-5-13(11)16/h3-8H,1-2H3,(H,17,18)
    • InChI Key： QQHYNRATBOSKAP-UHFFFAOYSA-N
    • SMILES： FC1=CC=C(C(=O)O)C=C1C1C=C(C=CC=1OC)OC

Computed Properties

  • Exact Mass: 276.07978705Da
  • Monoisotopic Mass: 276.07978705Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 4
  • Complexity: 336
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.1
  • Topological Polar Surface Area: 55.8?2

3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB328572-5 g
3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid, 95%; .
 1261980-64-6 95%
5g
 €1159.00 2023-04-26
abcr
AB328572-5g
3-(2,5-Dimethoxyphenyl)-4-fluorobenzoic acid, 95%; .
 1261980-64-6 95%
5g
 €1159.00 2025-04-21

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