| CAS Number | 2096339-84-1 |
| Catalog Number | AG01EHFO |
| Chemical Name | 3,5-Difluoro-4-isobutoxyphenylboronic acid |
| IUPAC Name | [3,5-difluoro-4-(2-methylpropoxy)phenyl]boronic acid |
| InChI | InChI=1S/C10H13BF2O3/c1-6(2)5-16-10-8(12)3-7(11(14)15)4-9(10)13/h3-4,6,14-15H,5H2,1-2H3 |
| InChI Key | WOGNDMLESCLXOR-UHFFFAOYSA-N |
| MDL Number | MFCD20231444 |
| Molecular Formula | C10H13BF2O3 |
| Molecular Weight | 230.0162 |
| SMILES | CC(COc1c(F)cc(cc1F)B(O)O)C |
| Synonyms | 3,5-Difluoro-4-isobutoxyphenylboronic acid,
2096339-84-1,
(3,5-Difluoro-4-isobutoxyphenyl)boronic acid,
MFCD20231444,
ZINC169955284,
Y2441,
B-9297,
C10H13BF2O3,
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| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.018g/mol |
| Monoisotopic Mass | 230.093g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number