4-Methoxypyridine-3-boronic Acid Pinacol Ester - CAS 758699-74-0
Catalog: |
BB035426 |
Product Name: |
4-Methoxypyridine-3-boronic Acid Pinacol Ester |
CAS: |
758699-74-0 |
Synonyms: |
4-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 4-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
IUPAC Name: | 4-methoxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
Description: | 4-Methoxypyridine-3-boronic Acid Pinacol Ester (CAS# 758699-74-0) is a useful research chemical compound. |
Molecular Weight: | 235.09 |
Molecular Formula: | C12H18NO3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=C(C=CN=C2)OC |
InChI: | InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-8-14-7-6-10(9)15-5/h6-8H,1-5H3 |
InChI Key: | FVHUFNSLTSKBDN-UHFFFAOYSA-N |
Boiling Point: | 346.748 °C at 760 mmHg |
Density: | 1.067 g/cm3 |
Appearance: | Solid |
MDL: | MFCD07367561 |
LogP: | 1.38940 |
Publication Number | Title | Priority Date |
WO-2020251974-A1 | Smarca inhibitors and uses thereof | 20190610 |
KR-20190126345-A | Inhibitors of beta secretase | 20170307 |
US-2020010482-A1 | Inhibitors of beta secretase | 20170307 |
US-2018230152-A1 | Compounds inhibiting leucine-rich repeat kinase enzyme activity | 20140903 |
US-10954240-B2 | Compounds inhibiting leucine-rich repeat kinase enzyme activity | 20140903 |
Complexity: | 267 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 235.1379736 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 235.1379736 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 40.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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