| CAS Number | 1314930-97-6 |
| Catalog Number | AG01DYNG |
| Chemical Name | 3-tert-Butyl-5-chloro-1,2-oxazole |
| IUPAC Name | 3-tert-butyl-5-chloro-1,2-oxazole |
| InChI | InChI=1S/C7H10ClNO/c1-7(2,3)5-4-6(8)10-9-5/h4H,1-3H3 |
| InChI Key | NTOFOPKWYDOUEY-UHFFFAOYSA-N |
| MDL Number | MFCD11216996 |
| Molecular Formula | C7H10ClNO |
| Molecular Weight | 159.6134 |
| SMILES | CC(C1=NOC(Cl)=C1)(C)C |
| Synonyms | 3-tert-butyl-5-chloro-1,2-oxazole,
1314930-97-6,
SCHEMBL16418628,
AKOS006308232,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.613g/mol |
| Monoisotopic Mass | 159.045g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number