| CAS Number | 2106467-58-5 |
| Catalog Number | AG01EIO9 |
| Chemical Name | ethyl 5-chloro-3-cyclobutyl-1,2-oxazole-4-carboxylate |
| IUPAC Name | ethyl 5-chloro-3-cyclobutyl-1,2-oxazole-4-carboxylate |
| InChI | InChI=1S/C10H12ClNO3/c1-2-14-10(13)7-8(6-4-3-5-6)12-15-9(7)11/h6H,2-5H2,1H3 |
| InChI Key | BQUVSWBTHACAAC-UHFFFAOYSA-N |
| MDL Number | MFCD31448480 |
| Molecular Formula | C10H12ClNO3 |
| Molecular Weight | 229.6602 |
| SMILES | CCOC(C1C(C2CCC2)=NOC=1Cl)=O |
| Synonyms | ethyl 5-chloro-3-cyclobutyl-1,2-oxazole-4-carboxylate,
2106467-58-5,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.66g/mol |
| Monoisotopic Mass | 229.051g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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