Cas no 74375-66-9 (2,1,3-Benzothiadiazole-5-methanamine)

2,1,3-Benzothiadiazole-5-methanamine is a heterocyclic organic compound featuring a benzothiadiazole core with an aminomethyl functional group at the 5-position. This structure imparts unique electronic and photophysical properties, making it valuable in materials science, particularly in the development of organic semiconductors, fluorescent probes, and optoelectronic devices. Its electron-deficient benzothiadiazole moiety enhances charge transport characteristics, while the primary amine group offers reactivity for further functionalization. The compound exhibits strong absorption and emission in the visible spectrum, contributing to its utility in light-harvesting applications. Its stability and synthetic versatility make it a preferred intermediate for designing advanced functional materials with tailored optical and electronic properties.
2,1,3-Benzothiadiazole-5-methanamine structure
74375-66-9 structure
Product Name:2,1,3-Benzothiadiazole-5-methanamine
CAS No:74375-66-9
MF:C7H7N3S
MW:165.215579271317
CID:577428
PubChem ID:3058007
Update Time:2025-05-27

2,1,3-Benzothiadiazole-5-methanamine Chemical and Physical Properties

Names and Identifiers

    • 2,1,3-benzothiadiazol-5-ylmethanamine
    • 2,1,3-Benzothiadiazole-5-methanamine
    • 2,1,3-Benzothiadiazol-2(S(sup IV))-5-methanamine
    • 5-Aminomethylbenzo-2,1,3-thiadiazol
    • AC1MHUMU
    • Ambcb4003734
    • BRN 0129043
    • C-benzo[1,2,5]thiadiazol-5-yl-methylamine
    • CTK2I0542
    • SureCN3275924
    • (2,1,3-Benzothiadiazol-5-ylmethyl)amine, AldrichCPR
    • 4-27-00-08099 (Beilstein Handbook Reference)
    • (2,1,3-benzothiadiazol-5-ylmethyl)amine
    • CS-0286130
    • 74375-66-9
    • EN300-1696975
    • DTXSID40225371
    • AKOS006282318
    • (2,1,3-benzothiadiazol-5-yl)methanamine
    • 1-(2,1,3-BENZOTHIADIAZOL-5-YL)METHANAMINE
    • SCHEMBL3275924
    • Benzo[c][1,2,5]thiadiazol-5-ylmethanamine
    • Inchi: 1S/C7H7N3S/c8-4-5-1-2-6-7(3-5)10-11-9-6/h1-3H,4,8H2
    • InChI Key: URBXYCAJWJKVEC-UHFFFAOYSA-N
    • SMILES: S1N=C2C=CC(CN)=CC2=N1

Computed Properties

  • Exact Mass: 165.03606841g/mol
  • Monoisotopic Mass: 165.03606841g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 142
  • 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: 0.6
  • Topological Polar Surface Area: 80?2

Experimental Properties

  • Density: 1.383
  • Boiling Point: 291.9°Cat760mmHg
  • Flash Point: 130.3°C
  • Refractive Index: 1.718

2,1,3-Benzothiadiazole-5-methanamine Pricemore >>

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