Cas no 15058-72-7 (2,4-dimethylfuran-3-carboxylic acid)

2,4-dimethylfuran-3-carboxylic acid structure
15058-72-7 structure
Product Name:2,4-dimethylfuran-3-carboxylic acid
CAS No:15058-72-7
MF:C7H8O3
MW:140.136622428894
MDL:MFCD08692087
CID:903926
PubChem ID:638456
Update Time:2025-04-19

2,4-dimethylfuran-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2,4-Dimethyl-furan-3-carboxylic acid
    • 2,4-dimethylfuran-3-carboxylic acid
    • IFLAB-BB F2124-0958
    • 2,4-Dimethyl-3-furancarboxylic Acid
    • 2,4-Dimethyl-3-furoic acid
    • 2,4-Dimethyl-furan-3-carbonsaeure
    • 2,4-dimethylfuran-3-carboxylate
    • 3-furancarboxylic acid,2,4-dimethyl
    • F2124-0958
    • 3-Furancarboxylic acid, 2,4-diMethyl-
    • 2,4-Dimethyl-3-furoic acid, 97%
    • SCHEMBL1800550
    • MFCD08692087
    • Z1198181048
    • 2,4-dimethylfuran-3-carboxylicacid
    • InChI=1/C7H8O3/c1-4-3-10-5(2)6(4)7(8)9/h3H,1-2H3,(H,8,9
    • 2,4-Dimethylfurane-3-carboxylic acid
    • EN300-129395
    • DB-063862
    • AT17497
    • AKOS005206977
    • MS-22580
    • A926348
    • 15058-72-7
    • DTXSID90348564
    • MDL： MFCD08692087
    • Inchi： 1S/C7H8O3/c1-4-3-10-5(2)6(4)7(8)9/h3H,1-2H3,(H,8,9)
    • InChI Key： JFXXYKVSLHRBAA-UHFFFAOYSA-N
    • SMILES： O1C=C(C)C(C(=O)O)=C1C

Computed Properties

  • Exact Mass: 140.04700
  • Monoisotopic Mass: 140.047344113g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 144
  • 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: 1.3
  • Topological Polar Surface Area: 50.4?2

Experimental Properties

  • PSA: 50.44000
  • LogP: 1.59460

2,4-dimethylfuran-3-carboxylic acid Security Information

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