| CAS Number | 2096333-35-4 |
| Catalog Number | AG01EHIT |
| Chemical Name | 3-Bromo-5-t-butyl-2-fluorophenylboronic acid |
| IUPAC Name | (3-bromo-5-tert-butyl-2-fluorophenyl)boronic acid |
| InChI | InChI=1S/C10H13BBrFO2/c1-10(2,3)6-4-7(11(14)15)9(13)8(12)5-6/h4-5,14-15H,1-3H3 |
| InChI Key | KFIDBWNQEIABRB-UHFFFAOYSA-N |
| MDL Number | MFCD18783155 |
| Molecular Formula | C10H13BBrFO2 |
| Molecular Weight | 274.9224 |
| SMILES | OB(c1cc(cc(c1F)Br)C(C)(C)C)O |
| Synonyms | 3-BROMO-5-T-BUTYL-2-FLUOROPHENYLBORONIC ACID,
2096333-35-4,
(3-Bromo-5-(tert-butyl)-2-fluorophenyl)boronic acid,
C10H13BBrFO2,
MFCD18783155,
ZINC169934972,
Y2492,
A-3298,
A-3922,
N/A,
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| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.018g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.924g/mol |
| Monoisotopic Mass | 274.018g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number