| CAS Number | 1238196-62-7 |
| Catalog Number | AG01EKW0 |
| Chemical Name | B-(2,3-DIFLUORO-6-HYDROXYPHENYL)-BORONIC ACID |
| IUPAC Name | (2,3-difluoro-6-hydroxyphenyl)boronic acid |
| InChI | InChI=1S/C6H5BF2O3/c8-3-1-2-4(10)5(6(3)9)7(11)12/h1-2,10-12H |
| InChI Key | KOWZIVQZEGPNSW-UHFFFAOYSA-N |
| MDL Number | MFCD03095114 |
| Molecular Formula | C6H5BF2O3 |
| Molecular Weight | 173.9099 |
| SMILES | FC1=C(C(=CC=C1F)O)B(O)O |
| Synonyms | (2,3-difluoro-6-hydroxyphenyl)boronic acid,
1238196-62-7,
AC1NA7FT,
Boronic acid, B-(2,3-difluoro-6-hydroxyphenyl)-,
CTK7I2571,
DTXSID30402538,
D-1755,
5,6-DIFLUORO-2-HYDROXYPHENYLBORONIC ACID,
B-(2,3-DIFLUORO-6-HYDROXYPHENYL)-BORONIC ACID,
CID4372783,
(2,3-difluoro-6-hydroxy-phenyl)boronic Acid,
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| 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