2,3-Dihydrobenzofuran-5-boronic Acid Pinacol Ester - CAS 937591-69-0
Catalog: |
BB041060 |
Product Name: |
2,3-Dihydrobenzofuran-5-boronic Acid Pinacol Ester |
CAS: |
937591-69-0 |
Synonyms: |
2-(2,3-dihydrobenzofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; 2-(2,3-dihydro-1-benzofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
IUPAC Name: | 2-(2,3-dihydro-1-benzofuran-5-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
Description: | 2,3-Dihydrobenzofuran-5-boronic Acid Pinacol Ester (CAS# 937591-69-0) is a useful research chemical. |
Molecular Weight: | 246.11 |
Molecular Formula: | C14H19O3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)OCC3 |
InChI: | InChI=1S/C14H19BO3/c1-13(2)14(3,4)18-15(17-13)11-5-6-12-10(9-11)7-8-16-12/h5-6,9H,7-8H2,1-4H3 |
InChI Key: | RWJUUXWJBMIGKA-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD09743046 |
LogP: | 1.92070 |
Publication Number | Title | Priority Date |
WO-2021053617-A1 | Mll1 inhibitors and anti-cancer agents | 20190920 |
US-2020283425-A1 | Pyrimidine sulfamide derivative and preparation method and medical application thereof | 20171121 |
EP-3294728-A1 | Substituted quinoxaline derivatives | 20150513 |
US-2018118718-A1 | Substituted Quinoxaline Derivatives | 20150513 |
WO-2016180537-A1 | Substituted quinoxaline derivatives | 20150513 |
Complexity: | 313 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 246.1427246 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 246.1427246 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 27.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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