Cas no 892674-22-5 (2,7-Dimethylquinoline-4-carboxylic acid)

2,7-Dimethylquinoline-4-carboxylic acid is a quinoline derivative characterized by its carboxylic acid functional group and methyl substituents at the 2- and 7-positions. This compound is of interest in organic synthesis and pharmaceutical research due to its structural framework, which serves as a versatile intermediate for the development of bioactive molecules. Its distinct substitution pattern enhances stability and influences reactivity, making it suitable for applications in heterocyclic chemistry. The carboxylic acid moiety allows for further functionalization, enabling the synthesis of amides, esters, and other derivatives. This compound is typically utilized in research settings for its potential in medicinal chemistry and material science applications.
2,7-Dimethylquinoline-4-carboxylic acid structure
892674-22-5 structure
Product Name:2,7-Dimethylquinoline-4-carboxylic acid
CAS No:892674-22-5
MF:C12H11NO2
MW:201.221243143082
CID:1074730
PubChem ID:16475941
Update Time:2025-10-29

2,7-Dimethylquinoline-4-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 2,7-Dimethylquinoline-4-carboxylic acid
    • 2,7-dimethylquinoline-4-carboxylic acid(SALTDATA: FREE)
    • CHEMBRDG-BB 4003771
    • 2,5-DIMETHYLPHENYL ACETATE
    • 2,7-Dimethyl-4-quinolinecarboxylic acid
    • AKOS005421115
    • E84434
    • SB68641
    • NCGC00339009-01
    • 892674-22-5
    • DTXSID50586122
    • BS-36880
    • AB01330768-02
    • MFCD08681035
    • 2,7-dimethylquinoline-4-carboxylicacid
    • STK237444
    • MDL: MFCD08681035
    • Inchi: 1S/C12H11NO2/c1-7-3-4-9-10(12(14)15)6-8(2)13-11(9)5-7/h3-6H,1-2H3,(H,14,15)
    • InChI Key: ICCQYBHJLONXFL-UHFFFAOYSA-N
    • SMILES: OC(C1C=C(C)N=C2C=C(C)C=CC2=1)=O

Computed Properties

  • Exact Mass: 201.07900
  • Monoisotopic Mass: 201.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 254
  • 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: 2.5
  • Topological Polar Surface Area: 50.2?2

Experimental Properties

  • Density: 1.2±0.1 g/cm3
  • Melting Point: 255℃
  • Boiling Point: 359.7±37.0 °C at 760 mmHg
  • Flash Point: 171.3±26.5 °C
  • PSA: 50.19000
  • LogP: 2.54980
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

2,7-Dimethylquinoline-4-carboxylic acid Security Information

2,7-Dimethylquinoline-4-carboxylic acid Customs Data

  • HS CODE:2933499090
  • Customs Data:

    China Customs Code:

    2933499090

    Overview:

    2933499090. Other compounds containing quinoline or isoquinoline ring system [but not further fused]. 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, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2,7-Dimethylquinoline-4-carboxylic acid Pricemore >>

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