| CAS Number | 857062-57-8 |
| Catalog Number | AG01A6SP(AGN-PC-0ET08J) |
| Chemical Name | 4,6-difluoro-2,3-dihydro-1-benzofuran-3-one |
| IUPAC Name | 4,6-difluoro-1-benzofuran-3-one |
| InChI | InChI=1S/C8H4F2O2/c9-4-1-5(10)8-6(11)3-12-7(8)2-4/h1-2H,3H2 |
| InChI Key | WFXCNBKZBYQYLP-UHFFFAOYSA-N |
| MDL Number | MFCD17216141 |
| Molecular Formula | C8H4F2O2 |
| Molecular Weight | 170.1130 |
| SMILES | FC1=CC(F)=C2C(OCC2=O)=C1 |
| Synonyms | 4,6-difluoro-2,3-dihydro-1-benzofuran-3-one,
857062-57-8,
3(2H)-Benzofuranone, 4,6-difluoro-,
SCHEMBL4739745,
ZINC54931945,
AKOS012079401,
NE56748,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.018g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.115g/mol |
| Monoisotopic Mass | 170.018g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number