| CAS Number | 2096341-56-7 |
| Catalog Number | AG01EHJ7 |
| Chemical Name | 3-Chloro-2-propoxypyridine-4-boronic acid |
| IUPAC Name | (3-chloro-2-propoxypyridin-4-yl)boronic acid |
| InChI | InChI=1S/C8H11BClNO3/c1-2-5-14-8-7(10)6(9(12)13)3-4-11-8/h3-4,12-13H,2,5H2,1H3 |
| InChI Key | ZJVIKLLXTWGQPM-UHFFFAOYSA-N |
| MDL Number | MFCD18434422 |
| Molecular Formula | C8H11BClNO3 |
| Molecular Weight | 215.4418 |
| SMILES | OB(C1=C(Cl)C(OCCC)=NC=C1)O |
| Synonyms | 3-CHLORO-2-PROPOXYPYRIDINE-4-BORONIC ACID,
2096341-56-7,
(3-chloro-2-propoxypyridin-4-yl)boronic acid,
MFCD18434422,
AKOS027351050,
ZINC169934757,
Y2519,
A-3510,
C8H11BClNO3,
|
| Complexity | 173 |
| 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 | 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