2,4-Dimethoxyphenylboronic Acid - CAS 133730-34-4
Catalog: |
BB007801 |
Product Name: |
2,4-Dimethoxyphenylboronic Acid |
CAS: |
133730-34-4 |
Synonyms: |
(2,4-dimethoxyphenyl)boronic acid; (2,4-dimethoxyphenyl)boronic acid |
IUPAC Name: | (2,4-dimethoxyphenyl)boronic acid |
Description: | 2,4-Dimethoxyphenylboronic acid can be used: As a reactant in meatal-catalyzed Suzuki−Miyaura cross-coupling reaction; To prepare hydroxy(trimethoxy)phenanthrene by cross-coupling with bromo(benzyloxy)methoxybenzaldehyde followed by condensation and debenzylation reaction; To synthesize 2,4-dimethoxy-1-(trifluoromethyl)benzene via Cu-catalyzed trifluoromethylation reaction. |
Molecular Weight: | 181.98 |
Molecular Formula: | C8H11O4B |
Canonical SMILES: | B(C1=C(C=C(C=C1)OC)OC)(O)O |
InChI: | InChI=1S/C8H11BO4/c1-12-6-3-4-7(9(10)11)8(5-6)13-2/h3-5,10-11H,1-2H3 |
InChI Key: | SQTUYFKNCCBFRR-UHFFFAOYSA-N |
Boiling Point: | 361.1 °C at 760 mmHg |
Melting Point: | 125-127 °C (lit.) |
Flash Point: | Not applicable |
Purity: | 95 % |
Density: | 1.19 g/cm3 |
MDL: | MFCD01074590 |
LogP: | -0.61640 |
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-111808434-A | Method for preparing naphthol AS series azo dye | 20200720 |
CN-111808434-B | Method for preparing naphthol AS series azo dye | 20200720 |
CN-111559990-A | Micromolecular oxathiazine derivative and application thereof | 20200529 |
CN-111559990-B | Micromolecular oxathiazine derivative and application thereof | 20200529 |
CN-111440137-A | 3, 4-benzocoumarin derivative and preparation method and application thereof | 20200428 |
PMID | Publication Date | Title | Journal |
21582929 | 20090624 | 2,4-Dibutoxy-phenyl-boronic acid | Acta crystallographica. Section E, Structure reports online |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 182.0750390 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 182.0750390 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 58.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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