Cas no 1261979-33-2 (2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid)

2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid is a fluorinated benzoic acid derivative featuring a chloro-substituted phenyl ring with a methoxycarbonyl functional group. This compound is of interest in pharmaceutical and agrochemical research due to its structural versatility, which allows for further derivatization into active intermediates. The presence of both electron-withdrawing (fluoro and chloro) and electron-donating (methoxycarbonyl) groups enhances its reactivity in cross-coupling and substitution reactions. Its well-defined aromatic framework makes it a valuable building block for synthesizing complex molecules with potential biological activity. High purity and stability under standard conditions ensure reliable performance in synthetic applications.
2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid structure
1261979-33-2 structure
Product Name:2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid
CAS No:1261979-33-2
MF:C15H10ClFO4
MW:308.688907146454
MDL:MFCD18322689
CID:2767286
PubChem ID:53228508
Update Time:2025-05-26

2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2-(4-CHLORO-3-METHOXYCARBONYLPHENYL)-6-FLUOROBENZOIC ACID
    • MFCD18322689
    • 4'-Chloro-3-fluoro-3'-(methoxycarbonyl)[1,1'-biphenyl]-2-carboxylic acid
    • 2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid, 95%
    • 1261979-33-2
    • DTXSID60692041
    • 2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid
    • MDL： MFCD18322689
    • Inchi： 1S/C15H10ClFO4/c1-21-15(20)10-7-8(5-6-11(10)16)9-3-2-4-12(17)13(9)14(18)19/h2-7H,1H3,(H,18,19)
    • InChI Key： JACYGZLXBPSTHK-UHFFFAOYSA-N
    • SMILES： ClC1C=CC(=CC=1C(=O)OC)C1C=CC=C(C=1C(=O)O)F

Computed Properties

  • Exact Mass: 308.0251647Da
  • Monoisotopic Mass: 308.0251647Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 403
  • 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: 3.7
  • Topological Polar Surface Area: 63.6?2

2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB329966-5g
2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid, 95%; .
 1261979-33-2 95%
5g
 €1159.00 2025-04-21
abcr
AB329966-5 g
2-(4-Chloro-3-methoxycarbonylphenyl)-6-fluorobenzoic acid, 95%; .
 1261979-33-2 95%
5g
 €1159.00 2023-04-26

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