4-Methoxy-2-methylphenylboronic Acid - CAS 208399-66-0
Catalog: |
BB016341 |
Product Name: |
4-Methoxy-2-methylphenylboronic Acid |
CAS: |
208399-66-0 |
Synonyms: |
(4-methoxy-2-methylphenyl)boronic acid; (4-methoxy-2-methylphenyl)boronic acid |
IUPAC Name: | (4-methoxy-2-methylphenyl)boronic acid |
Description: | Reactant for preparation of biologically active molecules: Preparation of hydroxyphenylnaphthols as 17ß-hydroxysteroid dehydrogenase Type 2 inhibitors. Reactant for: Preparation of axially-chiral biarylphosphonates by asymmetric Suzuki coupling catalyzed by palladium complexes with helically-chiral polyquinoxaline phosphine and polyphosphine copolymers; Preparation of arylpyrimidines and their use in regioselective acetoxylation; Preparation of N-arylated azoles via copper fluorapatite-catalyzed arylation. |
Molecular Weight: | 165.98 |
Molecular Formula: | C8H11O3B |
Canonical SMILES: | B(C1=C(C=C(C=C1)OC)C)(O)O |
InChI: | InChI=1S/C8H11BO3/c1-6-5-7(12-2)3-4-8(6)9(10)11/h3-5,10-11H,1-2H3 |
InChI Key: | AMSQNQJCBXQYEX-UHFFFAOYSA-N |
Boiling Point: | 327.1 °C at 760 mmHg |
Melting Point: | 169-174 °C (lit.) |
Flash Point: | Not applicable |
Purity: | ≥ 95 % |
Density: | 1.14 g/cm3 |
Appearance: | Off-white powder |
MDL: | MFCD02684315 |
LogP: | -0.31660 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-112877372-A | Process for preparing tertiary alpha-aryl cyclic ketones | 20210218 |
WO-2021074281-A1 | Substituted azacyles as trmp8 modulators | 20191017 |
WO-2021035101-A1 | Molecules that bind to tdp-43 for the treatment of amyotrophic lateral sclerosis and related disorders | 20190822 |
CN-111825508-A | Preparation method of dihydro 9-phenanthrene amine compound and chiral product prepared by same | 20190415 |
WO-2020151589-A1 | Acylamino bridged heterocyclic compound, and composition and application thereof | 20190125 |
PMID | Publication Date | Title | Journal |
21476502 | 20110520 | Synthesis, conformational stability, and asymmetric transformation of atropisomeric 1,8-bisphenolnaphthalenes | The Journal of organic chemistry |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.0801244 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.0801244 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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