| CAS Number | 2059994-75-9 |
| Catalog Number | AG01B5B3 |
| Chemical Name | 4-cyclopropyl-1,3-oxazole |
| IUPAC Name | 4-cyclopropyl-1,3-oxazole |
| InChI | InChI=1S/C6H7NO/c1-2-5(1)6-3-8-4-7-6/h3-5H,1-2H2 |
| InChI Key | IXOJKLGEJFHVBI-UHFFFAOYSA-N |
| MDL Number | MFCD30497498 |
| Molecular Formula | C6H7NO |
| Molecular Weight | 109.1259 |
| SMILES | C1C(C2N=COC=2)C1 |
| Synonyms | 4-cyclopropyl-1,3-oxazole,
2059994-75-9,
ZINC82220095,
|
| Complexity | 90.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 109.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 109.128g/mol |
| Monoisotopic Mass | 109.053g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number