Cas no 57543-62-1 (6-Methoxy-2H-chromene-3-carboxylic acid)

6-Methoxy-2H-chromene-3-carboxylic acid is a chromene derivative featuring a methoxy substituent at the 6-position and a carboxylic acid functional group at the 3-position. This compound serves as a versatile intermediate in organic synthesis, particularly in the development of heterocyclic compounds and pharmacologically active molecules. Its structural framework is valuable for constructing fused ring systems, often utilized in medicinal chemistry and material science. The presence of both electron-donating (methoxy) and electron-withdrawing (carboxylic acid) groups enhances its reactivity in selective transformations. It is commonly employed in the synthesis of flavonoids, coumarins, and other bioactive scaffolds, offering a balance of stability and synthetic utility for researchers.
6-Methoxy-2H-chromene-3-carboxylic acid structure
57543-62-1 structure
Product Name:6-Methoxy-2H-chromene-3-carboxylic acid
CAS No:57543-62-1
MF:C11H10O4
MW:206.194703578949
MDL:MFCD00202057
CID:843773
PubChem ID:2764028
Update Time:2025-10-19

6-Methoxy-2H-chromene-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 6-Methoxy-2H-chromene-3-carboxylic acid
    • DTXSID90377258
    • VOOCQPOSPBMQSK-UHFFFAOYSA-N
    • CCG-147970
    • MFCD00202057
    • 57543-62-1
    • 6-Methoxy-2H-chromene-3-carboxylic acid, AldrichCPR
    • AKOS000623158
    • BBL028383
    • Z228588852
    • SY173477
    • F2121-0015
    • 6-Methoxy-2H-3-chromenecarboxylic acid
    • STL372922
    • DB-072332
    • SCHEMBL3198679
    • HMS3449D15
    • 6-Methoxy-2H-chromene-3-carboxylicacid
    • AB04730
    • EN300-49437
    • J-519451
    • 5G-302S
    • MDL: MFCD00202057
    • Inchi: 1S/C11H10O4/c1-14-9-2-3-10-7(5-9)4-8(6-15-10)11(12)13/h2-5H,6H2,1H3,(H,12,13)
    • InChI Key: VOOCQPOSPBMQSK-UHFFFAOYSA-N
    • SMILES: O1CC(C(=O)O)=CC2C=C(C=CC1=2)OC

Computed Properties

  • Exact Mass: 206.05800
  • Monoisotopic Mass: 206.05790880g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 284
  • 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: 1.5
  • Topological Polar Surface Area: 55.8?2

Experimental Properties

  • Melting Point: 190-192°C
  • PSA: 55.76000
  • LogP: 1.55560

6-Methoxy-2H-chromene-3-carboxylic acid Security Information

  • Hazard Category Code: 36
  • Safety Instruction: 26
  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

6-Methoxy-2H-chromene-3-carboxylic acid Pricemore >>

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