| CAS Number | 1781976-43-9 |
| Catalog Number | AG01BAK8 |
| Chemical Name | 4-cyclopropyl-1,3-oxazole-5-carboxylic acid |
| IUPAC Name | 4-cyclopropyl-1,3-oxazole-5-carboxylic acid |
| InChI | InChI=1S/C7H7NO3/c9-7(10)6-5(4-1-2-4)8-3-11-6/h3-4H,1-2H2,(H,9,10) |
| InChI Key | YRBSRELYCRKVTD-UHFFFAOYSA-N |
| MDL Number | MFCD28505744 |
| Molecular Formula | C7H7NO3 |
| Molecular Weight | 153.1354 |
| SMILES | OC(C1=C(C2CC2)N=CO1)=O |
| Synonyms | 4-cyclopropyl-1,3-oxazole-5-carboxylic acid,
1781976-43-9,
ZINC75600594,
AKOS022673197,
Z2111526120,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.137g/mol |
| Monoisotopic Mass | 153.043g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number