1-Benzyl-1,2,3,6-tetrahydropyridine-4-boronic Acid Pinacol Ester - CAS 1048976-83-5
Catalog: |
BB001509 |
Product Name: |
1-Benzyl-1,2,3,6-tetrahydropyridine-4-boronic Acid Pinacol Ester |
CAS: |
1048976-83-5 |
Synonyms: |
1-(phenylmethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine; 1-benzyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine |
IUPAC Name: | 1-benzyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine |
Description: | 1-Benzyl-1,2,3,6-tetrahydropyridine-4-boronic Acid Pinacol Ester (CAS# 1048976-83-5) is a useful research chemical. |
Molecular Weight: | 299.22 |
Molecular Formula: | C18H26NO2B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CCN(CC2)CC3=CC=CC=C3 |
InChI: | InChI=1S/C18H26BNO2/c1-17(2)18(3,4)22-19(21-17)16-10-12-20(13-11-16)14-15-8-6-5-7-9-15/h5-10H,11-14H2,1-4H3 |
InChI Key: | SBZWAVVCJBBNSM-UHFFFAOYSA-N |
Boiling Point: | 357.709 °C at 760 mmHg |
Density: | 1.05 g/cm3 |
MDL: | MFCD11501654 |
LogP: | 3.38800 |
Publication Number | Title | Priority Date |
WO-2020210630-A1 | Tricyclic degraders of ikaros and aiolos | 20190412 |
CN-109762007-B | Process method for synthesizing N-substituted-1, 2,5, 6-tetrahydropyridine-4-boric acid ester | 20190227 |
EP-3083617-B1 | Isochromene derivatives as phosphoinositide 3-kinases inhibitors | 20131218 |
US-2015166549-A1 | Isochromene derivatives as phoshoinositide 3-kinases inhibitors | 20131218 |
US-9321776-B2 | Isochromene derivatives as phoshoinositide 3-kinases inhibitors | 20131218 |
Complexity: | 411 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 299.2056592 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 299.2056592 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 21.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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