Cas no 103261-70-7 (ethyl 1,3-benzothiazole-5-carboxylate)

Ethyl 1,3-benzothiazole-5-carboxylate is a heterocyclic ester compound featuring a benzothiazole core with a carboxylate functional group at the 5-position. This structure imparts versatility in organic synthesis, particularly as a building block for pharmaceuticals, agrochemicals, and materials science applications. The ethyl ester moiety enhances solubility in organic solvents, facilitating further derivatization. Its benzothiazole scaffold is known for contributing to biological activity, making it valuable in medicinal chemistry research. The compound exhibits stability under standard conditions, ensuring reliable handling and storage. Its well-defined reactivity profile allows for selective modifications, enabling the development of novel derivatives with tailored properties.
ethyl 1,3-benzothiazole-5-carboxylate structure
103261-70-7 structure
Product Name:ethyl 1,3-benzothiazole-5-carboxylate
CAS No:103261-70-7
MF:C10H9NO2S
MW:207.248961210251
MDL:MFCD13176733
CID:125562
PubChem ID:10608408
Update Time:2025-05-27

ethyl 1,3-benzothiazole-5-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl benzo[d]thiazole-5-carboxylate
    • 5-Benzothiazolecarboxylicacid,ethylester(6CI,9CI)
    • ethyl 1,3-benzothiazole-5-carboxylate
    • 5-Benzothiazolecarboxylicacid,ethylester
    • Ethyl Benzothiazole-5-carboxylate
    • SY041196
    • 5-benzothiazolecarboxylic acid ethyl ester
    • 5-Benzothiazolecarboxylic acid, ethyl ester
    • ST24025060
    • X8653
    • DS-16003
    • Y10374
    • EN300-843049
    • ethyl benzo[d]thiazole-5-carboxylate;Ethyl Benzothiazole-5-carboxylate
    • 103261-70-7
    • SCHEMBL260218
    • MFCD13176733
    • A23624
    • Ethylbenzo[d]thiazole-5-carboxylate
    • DTXSID70442418
    • AKOS015998719
    • CS-0043001
    • AC-25107
    • DB-129249
    • MDL: MFCD13176733
    • Inchi: 1S/C10H9NO2S/c1-2-13-10(12)7-3-4-9-8(5-7)11-6-14-9/h3-6H,2H2,1H3
    • InChI Key: ZSBYCGYHRQGYNA-UHFFFAOYSA-N
    • SMILES: S1C=NC2C=C(C(=O)OCC)C=CC1=2

Computed Properties

  • Exact Mass: 207.03500
  • Monoisotopic Mass: 207.03539970g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 222
  • 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: 67.4
  • XLogP3: 2.6

Experimental Properties

  • PSA: 67.43000
  • LogP: 2.47300

ethyl 1,3-benzothiazole-5-carboxylate Security Information

ethyl 1,3-benzothiazole-5-carboxylate Customs Data

  • HS CODE:2934200090
  • Customs Data:

    China Customs Code:

    2934200090

    Overview:

    2934200090. Other compounds containing a benzothiazole ring. 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:

    2934200090. other compounds containing in the structure a benzothiazole 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%

ethyl 1,3-benzothiazole-5-carboxylate Pricemore >>

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