| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2008 | 13 | Yes |
Popular Name: 6-bromo-2-methyl-2H-1,4-benzoxazin-3(4H)-one 6-bromo-2-methyl-2H-1,4-benzoxaz…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 221311-16-6 , [221311-16-6]
6-BROMO-2-METHYL-2H-BENZO[B][1,4]OXAZIN-3(4H)-ONE
| 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) | 2.13 | 3 | -5.86 | 1 | 3 | 0 | 38 | 242.072 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 188 - 190 | KeyOrganics |
| MP | 188-190° | Matrix Scientific |
| MP | 189 - 191 | Enamine Building Blocks |
| MP | 189...191 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
