Cas no 875664-52-1 (3,4-Difluoro-2-methoxybenzoic acid)

3,4-Difluoro-2-methoxybenzoic acid is a versatile organic compound with distinct aromatic properties. This compound exhibits high purity and stability, making it ideal for applications in organic synthesis and pharmaceutical research. Its unique fluorinated and methoxy groups provide enhanced reactivity and selectivity, facilitating the synthesis of complex organic molecules. The compound's consistent quality and purity ensure reliable performance in various chemical reactions.
3,4-Difluoro-2-methoxybenzoic acid structure
875664-52-1 structure
Product Name:3,4-Difluoro-2-methoxybenzoic acid
CAS No:875664-52-1
MF:C8H6F2O3
MW:188.128249645233
MDL:MFCD03428593
CID:69214
PubChem ID:24721619
Update Time:2025-10-17

3,4-Difluoro-2-methoxybenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3,4-Difluoro-2-methoxybenzoic acid
    • PC7836
    • 3,4-Difluoro-2-methoxyBenzoicacid98+%
    • 3,4-Difluoro-2-methoxybenzoic acid 97+%
    • 6-carboxy-2,3-difluoroanisole, 3,4-difluoro-o-anisic acid
    • PubChem10427
    • STL555026
    • BBL101230
    • SBB090705
    • CM12679
    • Benzoic acid,3,4-difluoro-2-methoxy-
    • AB0032872
    • 3,4-bis(fluoranyl)-2-methoxy-benzoic acid
    • X6307
    • ST24041146
    • 3,4-difluoro-2-methoxybenzoic acid, AldrichCPR
    • A842271
    • 664D521
    • 3,4-Difluoro-2-methoxybenzoic acid (ACI)
    • 3,4-Difluoro-2-methoxybenzoicacid
    • DTXSID70641065
    • SCHEMBL12756987
    • 875664-52-1
    • AKOS005257713
    • PS-8447
    • CS-0061930
    • EN300-1866678
    • DTXCID90591816
    • MFCD03428593
    • MDL: MFCD03428593
    • Inchi: 1S/C8H6F2O3/c1-13-7-4(8(11)12)2-3-5(9)6(7)10/h2-3H,1H3,(H,11,12)
    • InChI Key: BGBIVLWLYHILBQ-UHFFFAOYSA-N
    • SMILES: O=C(C1C(OC)=C(F)C(F)=CC=1)O

Computed Properties

  • Exact Mass: 188.02900
  • Monoisotopic Mass: 188.029
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 198
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 1.6
  • Topological Polar Surface Area: 46.5

Experimental Properties

  • Color/Form: White to cream needle crystals
  • Density: 1.399
  • Melting Point: 137-139°C
  • Boiling Point: 277oC
  • Flash Point: 121oC
  • Refractive Index: 1.512
  • PSA: 46.53000
  • LogP: 1.67160
  • Solubility: Insoluble in water

3,4-Difluoro-2-methoxybenzoic acid Security Information

3,4-Difluoro-2-methoxybenzoic acid Customs Data

  • HS CODE:2918990090
  • Customs Data:

    China Customs Code:

    2918990090

    Overview:

    2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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3,4-Difluoro-2-methoxybenzoic acid Production Method

Production Method 1

Reaction Conditions
1.1 Solvents: Toluene ;  2 h, reflux
Reference
A convenient and efficient approach to polyfluorosalicylic acids and their tuberculostatic activity
Shchegol'kov, Evgeny V.; et al, Bioorganic & Medicinal Chemistry Letters, 2016, 26(10), 2455-2458

Production Method 2

Reaction Conditions
1.1 Solvents: Toluene
Reference
Polyfluorinated salicylic acid derivatives as analogs of known drugs: Synthesis, molecular docking and biological evaluation
Shchegol'kov, E. V. ; et al, Bioorganic & Medicinal Chemistry, 2017, 25(1), 91-99

3,4-Difluoro-2-methoxybenzoic acid Raw materials

3,4-Difluoro-2-methoxybenzoic acid Preparation Products

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