Methyl 5-benzyl-3-methyl-1,2,4-dioxazole-3-carboxylate
methyl 5-benzyl-3-methyl-1,2,4-dioxazole-3-carboxylate
Also Known As: methyl 5-benzyl-3-methyl-1,2,4-dioxazole-3-carboxylate|Methyl 5-benzyl-3-methyl-3H-1,2,4-dioxazole-3-carboxylate|3H-1,2,4-DIOXAZOLE-3-CARBOXYLICACID, 3-METHYL-5-(PHENYLMETHYL)-, METHYL ESTER
CAS: 64686-56-2
| Molecular Formula | C12H13NO4 |
|---|---|
| Molecular Weight | 235.08446 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 57.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.08446 |
| Monoisotopic Mass | 235.08446 |
| Heavy Atoms | 17 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 64686-56-2 |
|---|---|
| SMILES | CC1(N=C(OO1)CC2=CC=CC=C2)C(=O)OC |
| InChIKey | DMOYYBTZVWSAED-UHFFFAOYSA-N |
Product Overview
Methyl 5-benzyl-3-methyl-1,2,4-dioxazole-3-carboxylate (CAS 64686-56-2), with molecular formula C12H13NO4 and molecular weight 235.08446 g/mol. IUPAC: methyl 5-benzyl-3-methyl-1,2,4-dioxazole-3-carboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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