5-(Benzyloxy)pyridine-3-boronic Acid Pinacol Ester - CAS 1375302-99-0
Catalog: |
BB008617 |
Product Name: |
5-(Benzyloxy)pyridine-3-boronic Acid Pinacol Ester |
CAS: |
1375302-99-0 |
Synonyms: |
3-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 3-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
IUPAC Name: | 3-phenylmethoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
Description: | 5-(Benzyloxy)pyridine-3-boronic Acid Pinacol Ester (CAS# 1375302-99-0) is a useful research chemical. |
Molecular Weight: | 311.18 |
Molecular Formula: | C18H22NO3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC(=CN=C2)OCC3=CC=CC=C3 |
InChI: | InChI=1S/C18H22BNO3/c1-17(2)18(3,4)23-19(22-17)15-10-16(12-20-11-15)21-13-14-8-6-5-7-9-14/h5-12H,13H2,1-4H3 |
InChI Key: | NAOLHUUUJHXGFQ-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
MDL: | MFCD11878281 |
LogP: | 2.95980 |
Publication Number | Title | Priority Date |
US-2021253568-A1 | Azaindole derivatives as rho-kinase inhibitors | 20180613 |
JP-2019508400-A | Quinolinone lysyl oxidase-like 2 inhibitors and their use | 20160209 |
US-10588900-B2 | Quinolinone lysyl oxidase-like 2 inhibitors and uses thereof | 20160209 |
US-2019046520-A1 | Quinolinone lysyl oxidase-like 2 inhibitors and uses thereof | 20160209 |
US-2020022972-A1 | Quinolinone lysyl oxidase-like 2 inhibitors and uses thereof | 20160209 |
Complexity: | 380 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 311.1692737 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 311.1692737 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 40.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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