| CAS Number | 1352796-65-6 |
| Catalog Number | AG009FPZ(AGN-PC-0WNRG0) |
| Chemical Name | 2-FluoropyriMidine-5-boronic acid pinacol ester |
| IUPAC Name | 2-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine |
| InChI | InChI=1S/C10H14BFN2O2/c1-9(2)10(3,4)16-11(15-9)7-5-13-8(12)14-6-7/h5-6H,1-4H3 |
| InChI Key | XFNGULIUEUPWIG-UHFFFAOYSA-N |
| MDL Number | MFCD13182191 |
| Molecular Formula | C10H14BFN2O2 |
| Molecular Weight | 224.0398 |
| SMILES | FC1=NC=C(C=N1)B1OC(C(O1)(C)C)(C)C |
| Synonyms | 1352796-65-6,
2-FLUOROPYRIMIDINE-5-BORONIC ACID PINACOL ESTER,
2-Fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine,
2-FLUOROPYRIMIDIN-5-YLBORONIC ACID PINACOL ESTER,
AKOS027322641,
ZINC206112469,
MB13052,
C-0041,
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| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 224.113g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 224.042g/mol |
| Monoisotopic Mass | 224.113g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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