Cas no 219763-06-1 (2-Methyl-1-benzofuran-5-carboxylic Acid)

2-Methyl-1-benzofuran-5-carboxylic Acid structure
219763-06-1 structure
Product Name:2-Methyl-1-benzofuran-5-carboxylic Acid
CAS No:219763-06-1
MF:C10H8O3
MW:176.168723106384
MDL:MFCD06589810
CID:243707
PubChem ID:1092118
Update Time:2025-04-19

2-Methyl-1-benzofuran-5-carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-Methylbenzofuran-5-carboxylic acid
    • 2-methyl-1-benzofuran-5-carboxylic acid
    • 2-Methyl-benzofuran-5-carboxylic acid
    • 5-Carboxy-2-methylbenzo[b]furan
    • AKOS000303452
    • JTNYNAOEJXGMCQ-UHFFFAOYSA-N
    • 2-methyl-benzofuran-5-carboxylic acid, AldrichCPR
    • AB01326386-02
    • FS-5580
    • SCHEMBL566569
    • NCGC00332234-01
    • 219763-06-1
    • MFCD06589810
    • DTXSID20360234
    • CS-0313642
    • HMS1701A03
    • 2-Methyl-1-benzofuran-5-carboxylic Acid
    • MDL: MFCD06589810
    • Inchi: 1S/C10H8O3/c1-6-4-8-5-7(10(11)12)2-3-9(8)13-6/h2-5H,1H3,(H,11,12)
    • InChI Key: JTNYNAOEJXGMCQ-UHFFFAOYSA-N
    • SMILES: O1C(C)=CC2C=C(C(=O)O)C=CC1=2

Computed Properties

  • Exact Mass: 176.04700
  • Monoisotopic Mass: 176.047
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 214
  • 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
  • Topological Polar Surface Area: 50.4A^2
  • Surface Charge: 0
  • XLogP3: 2.3

Experimental Properties

  • Density: 1.303
  • Boiling Point: 342.7°C at 760 mmHg
  • Flash Point: 161.1°C
  • Refractive Index: 1.631
  • PSA: 50.44000
  • LogP: 2.43940

2-Methyl-1-benzofuran-5-carboxylic Acid Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

2-Methyl-1-benzofuran-5-carboxylic Acid Customs Data

  • HS CODE:2932999099
  • Customs Data:

    China Customs Code:

    2932999099

    Overview:

    2932999099. Other heterocyclic compounds containing only oxygen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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