2-Isopropoxypyridine-3-boronic Acid Pinacol Ester - CAS 848243-25-4
Catalog: |
BB037326 |
Product Name: |
2-Isopropoxypyridine-3-boronic Acid Pinacol Ester |
CAS: |
848243-25-4 |
Synonyms: |
2-propan-2-yloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 2-propan-2-yloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
IUPAC Name: | 2-propan-2-yloxy-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine |
Description: | 2-Isopropoxypyridine-3-boronic Acid Pinacol Ester (CAS# 848243-25-4) is a useful research chemical. |
Molecular Weight: | 263.14 |
Molecular Formula: | C14H22NO3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=C(N=CC=C2)OC(C)C |
InChI: | InChI=1S/C14H22BNO3/c1-10(2)17-12-11(8-7-9-16-12)15-18-13(3,4)14(5,6)19-15/h7-10H,1-6H3 |
InChI Key: | DLFPLUKZBSELRD-UHFFFAOYSA-N |
Boiling Point: | 354.4 °C at 760 mmHg |
Flash Point: | Not applicable |
Density: | 1.03 g/cm3 |
MDL: | MFCD07366722 |
LogP: | 2.16800 |
Precautionary Statement: | P305 + P351 + P338 |
Publication Number | Title | Priority Date |
NZ-751398-A | Spirocyclic compounds | 20161005 |
AU-2012382373-A1 | Pyridinone and pyridazinone derivatives | 20120612 |
EP-2858990-B1 | Pyridinone and pyridazinone derivatives | 20120612 |
MX-2014015156-A | DERIVATIVES OF PIRIDINONA AND PIRIDAZINONA. | 20120612 |
TW-201410651-A | Pyridone and oxime ketone derivatives | 20120612 |
Complexity: | 304 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.1692737 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.1692737 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 40.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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