| CAS Number | 1310939-56-0 |
| Catalog Number | AG01AJMK |
| Chemical Name | {5-fluoro-2-[(oxolan-2-yl)methoxy]phenyl}boronic acid |
| IUPAC Name | [5-fluoro-2-(oxolan-2-ylmethoxy)phenyl]boronic acid |
| InChI | InChI=1S/C11H14BFO4/c13-8-3-4-11(10(6-8)12(14)15)17-7-9-2-1-5-16-9/h3-4,6,9,14-15H,1-2,5,7H2 |
| InChI Key | CVRNSCLHDCBFQW-UHFFFAOYSA-N |
| MDL Number | MFCD11183222 |
| Molecular Formula | C11H14BFO4 |
| Molecular Weight | 240.0359 |
| SMILES | OB(C1=C(OCC2OCCC2)C=CC(F)=C1)O |
| Synonyms | [5-fluoro-2-(oxolan-2-ylmethoxy)phenyl]boronic acid,
1310939-56-0,
NE18721,
EN300-81281,
[5-fluoro-2-(oxolan-2-ylmethoxy)phenyl]boranediol,
|
| Complexity | 242 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.097g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.037g/mol |
| Monoisotopic Mass | 240.097g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 58.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number