Cas no 1201597-23-0 (2,6-Difluoro-4-methylbenzoic acid)

2,6-Difluoro-4-methylbenzoic acid is a fluorinated aromatic carboxylic acid derivative characterized by its unique substitution pattern, featuring fluorine atoms at the 2- and 6-positions and a methyl group at the 4-position of the benzoic acid scaffold. This structural configuration enhances its utility as a versatile intermediate in pharmaceutical and agrochemical synthesis, where fluorine incorporation often improves metabolic stability and bioavailability. The compound's high purity and well-defined reactivity make it suitable for selective functionalization, particularly in cross-coupling reactions or as a building block for advanced heterocyclic systems. Its crystalline solid form ensures ease of handling and storage under standard laboratory conditions.
2,6-Difluoro-4-methylbenzoic acid structure
1201597-23-0 structure
Product Name:2,6-Difluoro-4-methylbenzoic acid
CAS No:1201597-23-0
MF:C8H6F2O2
MW:172.128849506378
MDL:MFCD11847292
CID:1026697
Update Time:2025-05-28

2,6-Difluoro-4-methylbenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2,6-Difluoro-4-methylbenzoic acid
    • AK-53650
    • AM62229
    • ANW-70569
    • CTK8C3807
    • KB-226185
    • SureCN290102
    • 2,6-DIFLUORO-4-METHYL-BENZOIC ACID
    • 2,6-Difluoro-4-methylbenzoicacid
    • NSHGGEJETYWOKY-UHFFFAOYSA-N
    • Benzoic acid, 2,6-difluoro-4-methyl-
    • SY034696
    • AB0065179
    • ST24021580
    • Z3965
    • Z1741980286
    • MDL: MFCD11847292
    • Inchi: 1S/C8H6F2O2/c1-4-2-5(9)7(8(11)12)6(10)3-4/h2-3H,1H3,(H,11,12)
    • InChI Key: NSHGGEJETYWOKY-UHFFFAOYSA-N
    • SMILES: FC1C=C(C)C=C(C=1C(=O)O)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 172
  • Topological Polar Surface Area: 37.3

2,6-Difluoro-4-methylbenzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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2,6-Difluoro-4-methylbenzoic acid
1201597-23-0 97%
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abcr
AB438648-250 mg
2,6-Difluoro-4-methylbenzoic acid, 95%; .
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abcr
AB438648-1 g
2,6-Difluoro-4-methylbenzoic acid, 95%; .
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abcr
AB438648-5 g
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Apollo Scientific
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