| CAS Number | 2096333-60-5 |
| Catalog Number | AG01EHO2 |
| Chemical Name | 6-(2-t-Butylphenoxy)pyridine-3-boronic acid |
| IUPAC Name | [6-(2-tert-butylphenoxy)pyridin-3-yl]boronic acid |
| InChI | InChI=1S/C15H18BNO3/c1-15(2,3)12-6-4-5-7-13(12)20-14-9-8-11(10-17-14)16(18)19/h4-10,18-19H,1-3H3 |
| InChI Key | AUPGMPCNGWLXGK-UHFFFAOYSA-N |
| MDL Number | MFCD22375014 |
| Molecular Formula | C15H18BNO3 |
| Molecular Weight | 271.1193 |
| SMILES | OB(c1ccc(nc1)Oc1ccccc1C(C)(C)C)O |
| Synonyms | 6-(2-t-Butylphenoxy)pyridine-3-boronic acid,
2096333-60-5,
(6-(2-(tert-Butyl)phenoxy)pyridin-3-yl)boronic acid,
MFCD22375014,
ZINC169978099,
Y2851,
B-9615,
C15H18BNO3,
|
| Complexity | 306 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.138g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.123g/mol |
| Monoisotopic Mass | 271.138g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 62.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number