3,5-Difluoro-4-formylphenylboronic acid - CAS 870718-11-9
Catalog: |
BB038237 |
Product Name: |
3,5-Difluoro-4-formylphenylboronic acid |
CAS: |
870718-11-9 |
Synonyms: |
(3,5-difluoro-4-formylphenyl)boronic acid |
IUPAC Name: | (3,5-difluoro-4-formylphenyl)boronic acid |
Description: | Reactant for: Preparation of pyrazolopyrimidinamine derivatives as tyrosine and phosphinositide kinase inhibitors; Preparation of boronate based D-glucose sensors. |
Molecular Weight: | 185.92 |
Molecular Formula: | C7H5BF2O3 |
Canonical SMILES: | B(C1=CC(=C(C(=C1)F)C=O)F)(O)O |
InChI: | InChI=1S/C7H5BF2O3/c9-6-1-4(8(12)13)2-7(10)5(6)3-11/h1-3,12-13H |
InChI Key: | XWZOKATWICIEMU-UHFFFAOYSA-N |
Boiling Point: | 342.1 °C at 760 mmHg |
Melting Point: | 255-260 °C |
Purity: | 98 % |
Density: | 1.42 g/cm3 |
MDL: | MFCD07784344 |
LogP: | -0.54290 |
Publication Number | Title | Priority Date |
CN-110711571-A | Preparation method of agarose boric acid affinity material suitable for purifying fish tropomyosin | 20190708 |
CN-110711571-B | Preparation method of agarose boric acid affinity material suitable for purifying fish tropomyosin | 20190708 |
WO-2020150372-A1 | Antimicrobial compounds and methods | 20190116 |
CN-113166093-A | Thiophene carboxamide derivative and plant disease control agent comprising the same | 20181008 |
EP-3865479-A1 | Thiophene carboxamide derivative and plant disease control agent comprising same | 20181008 |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0299805 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0299805 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 57.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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