| CAS Number | 1229584-22-8 |
| Catalog Number | AG009YLR |
| Chemical Name | 2,5-Difluoro-4-hydroxyphenylboronic acid |
| IUPAC Name | (2,5-difluoro-4-hydroxyphenyl)boronic acid |
| InChI | InChI=1S/C6H5BF2O3/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2,10-12H |
| InChI Key | BKSUWYUPEDFFDX-UHFFFAOYSA-N |
| MDL Number | MFCD18394881 |
| Molecular Formula | C6H5BF2O3 |
| Molecular Weight | 173.9099 |
| SMILES | OB(C1=CC(F)=C(O)C=C1F)O |
| Synonyms | 2,5-Difluoro-4-hydroxyphenylboronic acid,
1229584-22-8,
(2,5-difluoro-4-hydroxyphenyl)boronic acid,
MFCD18394881,
AKOS027425372,
ZINC169994365,
BC001495,
Y3922,
Q-8810,
BORONIC ACID, B-(2,5-DIFLUORO-4-HYDROXYPHENYL)-,
C6H5BF2O3,
|
| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.91g/mol |
| Monoisotopic Mass | 174.03g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 60.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number