| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2005 | 13 | No |
Popular Name: Ethyl 4-(chloromethyl)-5-methylisoxazole-3-carboxylate Ethyl 4-(chloromethyl)-5-methyli…
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CAS Numbers: 886498-32-4 , [886498-32-4]
4-Chloromethyl-5-methyl-isoxazole-3-carboxylic aci
4-Chloromethyl-5-methyl-isoxazole-3-carboxylic acid ethyl ester
ethyl 4-(chloromethyl)-5-methyl-1,2-oxazole-3-carboxylate
Ethyl 4-(chloromethyl)-5-methyl-3-isoxazolecarboxylate
Ethyl4-(chloromethyl)-5-methylisoxazole-3-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) | 1.59 | 5.42 | -7.79 | 0 | 4 | 0 | 52 | 203.625 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.