| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 17th, 2004 | 16 | Yes |
Popular Name: ethyl 6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate ethyl 6-chloro-3,4-dihydro-2H-1,…
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CAS Numbers: 1432053-90-1 , 68281-43-6 , [68281-43-6]
ethyl 6-chloro-3,4-dihydro-2H-1,4-benzoxazine-2-carboxylate hydrochloride
Ethyl 6-chloro-3,4-dihydro-2H-benzo[b][1,4]oxazine-2-carboxylate
ethyl6-chloro-3,4-dihydro-2h-1,4-benzoxazine-2-carboxylate
| 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) | 2.55 | -0.31 | -7.45 | 1 | 4 | 0 | 48 | 241.674 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 84 - 85 | KeyOrganics |
| MP | 84-85° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.