5-Formylfuran-2-boronic Acid Pinacol Ester - CAS 273731-82-1
Catalog: |
BB019551 |
Product Name: |
5-Formylfuran-2-boronic Acid Pinacol Ester |
CAS: |
273731-82-1 |
Synonyms: |
5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-furancarboxaldehyde; 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-carbaldehyde |
IUPAC Name: | 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-carbaldehyde |
Description: | 5-Formylfuran-2-boronic Acid Pinacol Ester could be useful for the diastereoselective synthesis of cyclic peptide macrocycles via Petasis borono-Mannich reaction. |
Molecular Weight: | 222.05 |
Molecular Formula: | C11H15O4B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC=C(O2)C=O |
InChI: | InChI=1S/C11H15BO4/c1-10(2)11(3,4)16-12(15-10)9-6-5-8(7-13)14-9/h5-7H,1-4H3 |
InChI Key: | VSQZZPPWTRWPTM-UHFFFAOYSA-N |
LogP: | 1.39130 |
Publication Number | Title | Priority Date |
CZ-2012712-A3 | Novel process for preparing key intermediate for the preparation of lapatinib o | 20121017 |
WO-2014059956-A1 | A method of producing the key intermediate of lapatinib synthesis | 20121017 |
Complexity: | 274 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.1063391 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.1063391 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 48.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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