2,4-Difluorophenylboronic Acid - CAS 144025-03-6
Catalog: |
BB009709 |
Product Name: |
2,4-Difluorophenylboronic Acid |
CAS: |
144025-03-6 |
Synonyms: |
(2,4-difluorophenyl)boronic acid; (2,4-difluorophenyl)boronic acid |
IUPAC Name: | (2,4-difluorophenyl)boronic acid |
Description: | Reactant involved in: End group capping; Suzuki-Miyaura cross-coupling reactions; Phosphorescent sensor for biologically mobile zinc and blue green phosphorescent OLEDs. Widely used in Suzuki coupling. |
Molecular Weight: | 157.91 |
Molecular Formula: | C6H5F2O2B |
Canonical SMILES: | B(C1=C(C=C(C=C1)F)F)(O)O |
InChI: | InChI=1S/C6H5BF2O2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,10-11H |
InChI Key: | QQLRSCZSKQTFGY-UHFFFAOYSA-N |
Boiling Point: | 251 °C at 760 mmHg |
Melting Point: | 247-250 °C (lit.) |
Flash Point: | Not applicable |
Purity: | ≥ 95 % |
Density: | 1.35 g/cm3 |
MDL: | MFCD01318998 |
LogP: | -0.35540 |
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-113307798-A | High-efficiency electroluminescent material and preparation method thereof | 20210526 |
CN-111961085-A | Preparation method and application of aggregation-induced emission halogen-modified platinum complex | 20200723 |
CN-111961085-B | Preparation method and application of aggregation-induced emission halogen-modified platinum complex | 20200723 |
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PMID | Publication Date | Title | Journal |
22065292 | 20110901 | Bis[3,5-difluoro-2-(4-methyl-pyridin-2-yl)phenyl-κC,N](picolinato-κN,O)iridium(III) chloro-form monosolvate | Acta crystallographica. Section E, Structure reports online |
21581686 | 20081210 | 2,4-Difluoro-phenyl-boronic acid | Acta crystallographica. Section E, Structure reports online |
21201131 | 20080913 | 1-(2',4'-Difluoro-biphenyl-4-yl)ethanone | Acta crystallographica. Section E, Structure reports online |
Complexity: | 134 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.0350659 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.0350659 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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