4-Phenoxyphenylboronic Acid Pinacol Ester - CAS 269410-26-6
Catalog: |
BB019419 |
Product Name: |
4-Phenoxyphenylboronic Acid Pinacol Ester |
CAS: |
269410-26-6 |
Synonyms: |
4,4,5,5-tetramethyl-2-(4-phenoxyphenyl)-1,3,2-dioxaborolane; 4,4,5,5-tetramethyl-2-(4-phenoxyphenyl)-1,3,2-dioxaborolane |
IUPAC Name: | 4,4,5,5-tetramethyl-2-(4-phenoxyphenyl)-1,3,2-dioxaborolane |
Description: | 4-Phenoxyphenylboronic Acid Pinacol Ester (CAS# 269410-26-6) is a useful research chemical. |
Molecular Weight: | 296.17 |
Molecular Formula: | C18H21O3B |
Canonical SMILES: | B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OC3=CC=CC=C3 |
InChI: | InChI=1S/C18H21BO3/c1-17(2)18(3,4)22-19(21-17)14-10-12-16(13-11-14)20-15-8-6-5-7-9-15/h5-13H,1-4H3 |
InChI Key: | SFCRPRMZQXUXOG-UHFFFAOYSA-N |
Boiling Point: | 432.48 °C at 760 mmHg |
Density: | 1.09 g/cm3 |
Appearance: | Solid |
MDL: | MFCD06795691 |
LogP: | 3.77810 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021071919-A1 | Hck as a therapeutic target in myd88 mutated diseases | 20191008 |
WO-2021071922-A1 | A pyrazolopyrimidine derivative as a hck inhibitor for use in therapy, in particular myd88 mutated diseases | 20191008 |
WO-2020263935-A1 | Hck degraders and uses thereof | 20190624 |
CN-108191871-B | Novel Bruton's tyrosine kinase inhibitor and preparation method and application thereof | 20180102 |
KR-102032418-B1 | Fused-pyrimidine derivatives, preparation method thereof, and pharmaceutical composition for use in preventing or treating Bruton's tyrosine kinase activity related diseases containing the same as an active ingredient | 20170615 |
Complexity: | 353 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 296.1583747 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 296.1583747 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 27.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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