| CAS Number | 1527583-05-6 |
| Catalog Number | AG018JTJ(AGN-PC-3H45BM) |
| Chemical Name | 2-Cyclobutyl-2-fluoroacetic acid |
| IUPAC Name | 2-cyclobutyl-2-fluoroacetic acid |
| InChI | InChI=1S/C6H9FO2/c7-5(6(8)9)4-2-1-3-4/h4-5H,1-3H2,(H,8,9) |
| InChI Key | XKGQKFCBGVZWMG-UHFFFAOYSA-N |
| MDL Number | MFCD24089361 |
| Molecular Formula | C6H9FO2 |
| Molecular Weight | 132.1329 |
| SMILES | O=C(O)C(F)C1CCC1 |
| Synonyms | 2-cyclobutyl-2-fluoroacetic acid,
1527583-05-6,
AKOS019919626,
F2147-5897,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 132.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 132.134g/mol |
| Monoisotopic Mass | 132.059g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number