| CAS Number | 2096341-71-6 |
| Catalog Number | AG01EHLD |
| Chemical Name | 3-Chloro-2-isopropoxypyridine-4-boronic acid |
| IUPAC Name | (3-chloro-2-propan-2-yloxypyridin-4-yl)boronic acid |
| InChI | InChI=1S/C8H11BClNO3/c1-5(2)14-8-7(10)6(9(12)13)3-4-11-8/h3-5,12-13H,1-2H3 |
| InChI Key | LTYSIEFEZIZESX-UHFFFAOYSA-N |
| MDL Number | MFCD18914509 |
| Molecular Formula | C8H11BClNO3 |
| Molecular Weight | 215.4418 |
| SMILES | CC(Oc1nccc(c1Cl)B(O)O)C |
| Synonyms | 3-Chloro-2-isopropoxypyridine-4-boronic acid,
2096341-71-6,
(3-Chloro-2-isopropoxypyridin-4-yl)boronic acid,
MFCD18914509,
ZINC169951666,
Y2518,
A-3019,
C8H11BClNO3,
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| Complexity | 182 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.44g/mol |
| Monoisotopic Mass | 215.052g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 62.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number