| Company Name: |
Sigma-Aldrich |
| Tel: |
021-61415566 800-8193336 |
| Email: |
orderCN@merckgroup.com |
|
| | 3-Methyl-2(3H)-benzothiazolone Basic information |
| | 3-Methyl-2(3H)-benzothiazolone Chemical Properties |
| Melting point | 74-77 °C (lit.) | | Boiling point | 130 °C(Press: 0.5 Torr) | | density | 1.315±0.06 g/cm3(Predicted) | | pka | -1.26±0.20(Predicted) | | InChI | 1S/C8H7NOS/c1-9-6-4-2-3-5-7(6)11-8(9)10/h2-5H,1H3 | | InChIKey | LSMMRJUHLKJNLR-UHFFFAOYSA-N | | SMILES | CN1C(=O)Sc2ccccc12 |
| WGK Germany | WGK 3 | | HS Code | 2934999090 | | Storage Class | 13 - Non Combustible Solids |
| | 3-Methyl-2(3H)-benzothiazolone Usage And Synthesis |
| Uses | 3-Methyl-2(3H)-benzothiazolone may be used for the synthesis of 2,3-dihydro-3-methyl-2- oxobenzo[d]oxazole-6-carbaldehyde and the 2,3-dihydro-3-methyl-2-oxobenzo[d]thiazole-6-carbaldehyde. It may be used for the synthesis of imidazole derivatives having 2(3H)-benzothiazolone moiety, which are potential antifungal agents. | | Synthesis Reference(s) | Journal of Heterocyclic Chemistry, 5, p. 769, 1968 DOI: 10.1002/jhet.5570050605 | | General Description | 3-Methyl-2(3H)-benzothiazolone is a five-membered heterocyclic compound. Its crystals belong to the orthorhombic crystal system and space group Pbca. |
| | 3-Methyl-2(3H)-benzothiazolone Preparation Products And Raw materials |
|