| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2008 | 13 | No |
Popular Name: 7-nitro-3,4-dihydro-2H-1,4-benzoxazine 7-nitro-3,4-dihydro-2H-1,4-benzo…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 120711-81-1 , [120711-81-1]
| 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) | 1.60 | 3.19 | -10.98 | 1 | 5 | 0 | 67 | 180.163 | 1 | ↓ |
| Hi High (pH 8-9.5) | 4.28 | 8 | -6.51 | 0 | 5 | 0 | 46 | 328.449 | 10 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 187 - 188 | KeyOrganics |
| MP | 187-188° | Matrix Scientific |
| Purity | 95% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
