| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: 2-methyl-4H-3,1-benzoxazin-4-one 2-methyl-4H-3,1-benzoxazin-4-one
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CAS Numbers: 525-76-8 , [525-76-8]
2-Methyl-4H-benzo[d][1,3]oxazin-4-one
4H-3,1-benzoxazin-4-one, 2-methyl-
| 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) | 1.51 | 3.52 | -8.92 | 0 | 3 | 0 | 43 | 161.16 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 81 - 83 | KeyOrganics |
| Warnings | IRRITANT | Matrix Scientific |
