| CAS Number | 2096330-91-3 |
| Catalog Number | AG01EHFP |
| Chemical Name | 2,4-Difluoro-5-hydroxyphenylboronic acid |
| IUPAC Name | (2,4-difluoro-5-hydroxyphenyl)boronic acid |
| InChI | InChI=1S/C6H5BF2O3/c8-4-2-5(9)6(10)1-3(4)7(11)12/h1-2,10-12H |
| InChI Key | NWNFZNVANLUANT-UHFFFAOYSA-N |
| MDL Number | MFCD18783139 |
| Molecular Formula | C6H5BF2O3 |
| Molecular Weight | 173.9099 |
| SMILES | FC1=C(C=C(C(=C1)F)O)B(O)O |
| Synonyms | 2,4-DIFLUORO-5-HYDROXYPHENYLBORONIC ACID,
2096330-91-3,
(2,4-difluoro-5-hydroxyphenyl)boronic acid,
KM3744,
MFCD18783139,
ZINC169934901,
Y2223,
C6H5BF2O3,
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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 |
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Certificate of Analysis
Lot Number