| CAS Number | 1822308-27-9 |
| Catalog Number | AG00I160(AGN-PC-0WQZXH) |
| Chemical Name | 2-(tert-Butyloxycarbonyl)pyrimidine-5-boronic acid pinacol ester |
| IUPAC Name | tert-butyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrimidine-2-carboxylate |
| InChI | InChI=1S/C15H23BN2O4/c1-13(2,3)20-12(19)11-17-8-10(9-18-11)16-21-14(4,5)15(6,7)22-16/h8-9H,1-7H3 |
| InChI Key | NWAMCEWEIFZABT-UHFFFAOYSA-N |
| MDL Number | MFCD30182409 |
| Molecular Formula | C15H23BN2O4 |
| Molecular Weight | 306.1651 |
| SMILES | O=C(c1ncc(cn1)B1OC(C(O1)(C)C)(C)C)OC(C)(C)C |
| Synonyms | 2-(tert-Butyloxycarbonyl)pyrimidine-5-boronic acid pinacol ester,
1822308-27-9,
|
| Complexity | 410 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 306.175g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 306.169g/mol |
| Monoisotopic Mass | 306.175g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 70.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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