| CAS Number | 1663470-21-0 |
| Catalog Number | AG00HZ5M |
| Chemical Name | 1,5-Naphthyridine-3,7-diboronic acid pinacol ester |
| IUPAC Name | 3,7-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,5-naphthyridine |
| InChI | InChI=1S/C20H28B2N2O4/c1-17(2)18(3,4)26-21(25-17)13-9-15-16(23-11-13)10-14(12-24-15)22-27-19(5,6)20(7,8)28-22/h9-12H,1-8H3 |
| InChI Key | MEBYQDZDPPSAEZ-UHFFFAOYSA-N |
| MDL Number | MFCD28369594 |
| Molecular Formula | C20H28B2N2O4 |
| Molecular Weight | 382.0693 |
| SMILES | CC1(C)OB(OC1(C)C)c1cnc2c(c1)ncc(c2)B1OC(C(O1)(C)C)(C)C |
| Synonyms | 1663470-21-0,
1,5-Naphthyridine-3,7-diboronic acid pinacol ester,
3,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,5-naphthyridine,
ZINC217047483,
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| Complexity | 529 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 382.224g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 382.074g/mol |
| Monoisotopic Mass | 382.224g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 62.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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