| CAS Number | 875-69-4 |
| Catalog Number | AG01FYNJ(AGN-PC-3H63C0) |
| Chemical Name | 5,7-dibromo-benzothiazole |
| IUPAC Name | 5,7-dibromo-1,3-benzothiazole |
| InChI | InChI=1S/C7H3Br2NS/c8-4-1-5(9)7-6(2-4)10-3-11-7/h1-3H |
| InChI Key | JYZZTBKMNYONOP-UHFFFAOYSA-N |
| MDL Number | MFCD12962849 |
| Molecular Formula | C7H3Br2NS |
| Molecular Weight | 292.9784 |
| SMILES | Brc1c2c(cc(c1)Br)ncs2 |
| Synonyms | 875-69-4,
5,7-Dibromobenzo[d]thiazole,
5,7-dibromo-1,3-benzothiazole,
Benzothiazole, 5,7-dibromo-,
5,7-DIBROMOBENZOTHIAZOLE,
DTXSID30696632,
ZINC44712732,
CS-16140,
CS-0090475,
W-3143,
5,7-dibromo-benzothiazole,
5,7-Dibromobenzo[d]thiazole, 97% - 10MG 10mg,
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| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 292.83325g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 292.98g/mol |
| Monoisotopic Mass | 290.8353g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 41.1Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number