| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 11 | Yes |
Popular Name: 5-BROMO-2-METHYLBENZOTHIAZOLE 5-BROMO-2-METHYLBENZOTHIAZOLE
Find On: PubMed — Wikipedia — Google
CAS Numbers: 63837-11-6 , [63837-11-6]
5-Bromo-2-methyl benzothiazole
5-Bromo-2-methyl-1,3-benzothiazole
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.87 | 5.34 | -5.77 | 0 | 1 | 0 | 13 | 228.114 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 170 / 10 | TCI |
| MP | 75-80° | Oakwood Chemical |
| MP | 79 | TCI |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.