Cas no 5262-63-5 (2,4-Dimethyl-benzothiazole)

2,4-Dimethyl-benzothiazole is a heterocyclic organic compound featuring a benzothiazole core substituted with methyl groups at the 2 and 4 positions. This structure imparts unique electronic and steric properties, making it valuable as an intermediate in organic synthesis, particularly in the development of dyes, pharmaceuticals, and agrochemicals. Its stability and reactivity under controlled conditions allow for selective functionalization, enabling tailored modifications for target applications. The compound’s rigid aromatic system enhances thermal and chemical resistance, which is advantageous in high-performance material formulations. Analytical-grade purity ensures consistency in research and industrial processes, supporting reproducible results in complex synthetic pathways.
2,4-Dimethyl-benzothiazole structure
2,4-Dimethyl-benzothiazole structure
Product Name:2,4-Dimethyl-benzothiazole
CAS No:5262-63-5
MF:C9H9NS
MW:163.239460706711
MDL:MFCD03161856
CID:366412
PubChem ID:12058632
Update Time:2025-05-28

2,4-Dimethyl-benzothiazole Chemical and Physical Properties

Names and Identifiers

    • 2,4-Dimethylbenzo[d]thiazole
    • 2,4-Dimethyl-benzothiazole
    • 2,4-dimethyl-1,3-benzothiazole
    • BENZOTHIAZOLE, 2,4-DIMETHYL- (6CI,7CI,8CI,9CI)
    • Benzothiazole,2,4-dimethyl-
    • 2,4-DIMETHYLBENZOTHIAZOLE
    • 2,4-Dimethyl-benzothiazol
    • 2,4-Dimethyl-benzthiazol
    • FC0644
    • AKOS006277794
    • Benzothiazole, 2,4-dimethyl-
    • 2,4-dimethyl-1,3-benzothiazole;2,4-Dimethylbenzothiazole
    • CS-0319892
    • A829177
    • SY038957
    • FT-0689534
    • 5262-63-5
    • MFCD03161856
    • SCHEMBL1748098
    • AS-76014
    • F15163
    • DTXSID40476644
    • dimethyl-benzothiazoline
    • DB-010713
    • MDL: MFCD03161856
    • Inchi: 1S/C9H9NS/c1-6-4-3-5-8-9(6)10-7(2)11-8/h3-5H,1-2H3
    • InChI Key: JKUXVIGPUOXPMM-UHFFFAOYSA-N
    • SMILES: S1C(C)=NC2=C1C=CC=C2C

Computed Properties

  • Exact Mass: 163.04600
  • Monoisotopic Mass: 163.04557046g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 149
  • 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: 3.1
  • Topological Polar Surface Area: 41.1?2

Experimental Properties

  • Boiling Point: 259.4°C at 760 mmHg
  • PSA: 41.13000
  • LogP: 2.91310

2,4-Dimethyl-benzothiazole Security Information

2,4-Dimethyl-benzothiazole Customs Data

  • HS CODE:2934999090
  • Customs Data:

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. 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:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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