| CAS Number | 1260161-42-9 |
| Catalog Number | AG01BJCZ |
| Chemical Name | 3-(2,4-difluorophenyl)cyclobutan-1-one |
| IUPAC Name | 3-(2,4-difluorophenyl)cyclobutan-1-one |
| InChI | InChI=1S/C10H8F2O/c11-7-1-2-9(10(12)5-7)6-3-8(13)4-6/h1-2,5-6H,3-4H2 |
| InChI Key | QUKQHIXLSVHVJH-UHFFFAOYSA-N |
| MDL Number | MFCD18073825 |
| Molecular Formula | C10H8F2O |
| Molecular Weight | 182.1667 |
| SMILES | FC1=CC(F)=C(C2CC(=O)C2)C=C1 |
| Synonyms | 3-(2,4-difluorophenyl)cyclobutan-1-one,
1260161-42-9,
ZINC83119913,
AKOS017515922,
F1913-0476,
|
| Complexity | 209 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.17g/mol |
| Monoisotopic Mass | 182.054g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number