3-[(2-Tetrahydropyranyl)oxy]phenylboronic Acid - CAS 1287777-05-2
Catalog: |
BB006934 |
Product Name: |
3-[(2-Tetrahydropyranyl)oxy]phenylboronic Acid |
CAS: |
1287777-05-2 |
Synonyms: |
[3-(2-oxanyloxy)phenyl]boronic acid; [3-(oxan-2-yloxy)phenyl]boronic acid |
IUPAC Name: | [3-(oxan-2-yloxy)phenyl]boronic acid |
Description: | 3-[(2-Tetrahydropyranyl)oxy]phenylboronic Acid (CAS# 1287777-05-2) is a useful research chemical. |
Molecular Weight: | 222.05 |
Molecular Formula: | C11H15O4B |
Canonical SMILES: | B(C1=CC(=CC=C1)OC2CCCCO2)(O)O |
InChI: | InChI=1S/C11H15BO4/c13-12(14)9-4-3-5-10(8-9)16-11-6-1-2-7-15-11/h3-5,8,11,13-14H,1-2,6-7H2 |
InChI Key: | GPYBHNZRMWCEAW-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 0.27180 |
Publication Number | Title | Priority Date |
EP-2558577-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
WO-2011127933-A1 | Bi-functional complexes and methods for making and using such complexes | 20100416 |
Complexity: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.1063391 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.1063391 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 58.9 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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