| CAS Number | 903513-60-0 |
| Catalog Number | AG00IG3X(AGN-PC-086F9X) |
| Chemical Name | (2-Cyanopyridin-4-yl)boronic acid |
| IUPAC Name | (2-cyanopyridin-4-yl)boronic acid |
| InChI | InChI=1S/C6H5BN2O2/c8-4-6-3-5(7(10)11)1-2-9-6/h1-3,10-11H |
| InChI Key | MSBPWGHYNOCHGC-UHFFFAOYSA-N |
| MDL Number | MFCD10696640 |
| Molecular Formula | C6H5BN2O2 |
| Molecular Weight | 147.9271 |
| SMILES | C(#N)C1=NC=CC(=C1)B(O)O |
| Synonyms | (2-CYANOPYRIDIN-4-YL)BORONIC ACID,
903513-60-0,
2-Cyanopyridine-4-boronic acid,
PubChem23551,
SCHEMBL2727397,
CTK8E4004,
DTXSID70678194,
MSBPWGHYNOCHGC-UHFFFAOYSA-N,
MFCD10696640,
AKOS006304108,
ZINC198023400,
AB57821,
Boronic acid, B-(2-cyano-4-pyridinyl)-,
DB-078654,
TX-016390,
FT-0764736,
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| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 148.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.928g/mol |
| Monoisotopic Mass | 148.044g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 77.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number