| CAS Number | 2096329-60-9 |
| Catalog Number | AG01EHCD |
| Chemical Name | 3-Bromo-4-t-butoxyphenylboronic acid |
| IUPAC Name | [3-bromo-4-[(2-methylpropan-2-yl)oxy]phenyl]boronic acid |
| InChI | InChI=1S/C10H14BBrO3/c1-10(2,3)15-9-5-4-7(11(13)14)6-8(9)12/h4-6,13-14H,1-3H3 |
| InChI Key | ASHARAKWVAFYLC-UHFFFAOYSA-N |
| MDL Number | MFCD18783124 |
| Molecular Formula | C10H14BBrO3 |
| Molecular Weight | 272.9314 |
| SMILES | Brc1cc(ccc1OC(C)(C)C)B(O)O |
| Synonyms | 3-BROMO-4-T-BUTOXYPHENYLBORONIC ACID,
2096329-60-9,
(3-Bromo-4-(tert-butoxy)phenyl)boronic acid,
MFCD18783124,
AKOS027372044,
ZINC169934807,
Y2474,
A-3297,
C10H14BBrO3,
A-3915,
N/A,
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| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 272.022g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.933g/mol |
| Monoisotopic Mass | 272.022g/mol |
| Rotatable Bond Count | 3 |
| 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