4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBORONIC ACID

Inquiry

Molecular Formula:

C8H8BF3O3

Molecular Weight:

219.95

CAS Number:

313546-16-6

Catalog Number:

313546-16-6

Product Information

Molecular Formula:

C8H8BF3O3

Molecular Weight:

219.95

Description

Reactant involved in:• Synthesis of pyrazine derivatives as corticotropin releasing factor-1 receptor antagonists• C-H functionalization of quinones• Phenyl-purine-carbonitrile derivative synthesis as cathepsin S inhibitors• Synthesis of chiral bicyclooctadiene-based ligands• Synthesis of corticotropin-releasing factor-1 antagonists

Synonyms

4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBORONIC ACID; 4-METHOXY-2-(TRIFLUOROMETHYL)BENZENEBORONIC ACID; 4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBORO&; 4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBRONIC ACID

IUPAC Name

[4-methoxy-2-(trifluoromethyl)phenyl]boronic acid

Canonical SMILES

B(C1=C(C=C(C=C1)OC)C(F)(F)F)(O)O

InChI

InChI=1S/C8H8BF3O3/c1-15-5-2-3-7(9(13)14)6(4-5)8(10,11)12/h2-4,13-14H,1H3

InChI Key

ZBCRZEJNAADYKG-UHFFFAOYSA-N

Boiling Point

314.1°C at 760mmHg

Melting Point

168-172°C

Flash Point

Not applicable

Purity

98%

Density

1.36g/cm3

Storage

2-8°C

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

220.0518588 g/mol

Monoisotopic Mass

220.0518588 g/mol

Topological Polar Surface Area

49.7Å²

Heavy Atom Count

Formal Charge

Complexity

210

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
CN-113861188-A	Pyrazolo [3,4-b ] pyridine derivative, preparation method thereof and application thereof as HPK1 inhibitor	2021-08-23
CN-113462200-A	Amino polymerization-resistant modified heat-conducting particle and preparation method thereof	2021-07-01
JP-2021089442-A	Photosensitive resin composition, photosensitive resin film, method for manufacturing cured product, laminate, and electronic components	2021-03-09
JP-2021073352-A	Curable composition and its cured product	2021-01-29
CN-112920614-A	High-temperature-resistant waterproof epoxy asphalt and preparation method thereof	2021-01-28
CN-112774731-A	Para-methoxy substituted palladium catalyst and application thereof in Heck reaction	2021-01-22
JP-2021059587-A	Pest control method for harmful arthropods using heterocyclic compounds	2020-12-25
JP-2021085037-A	Conductive pigment pastes, coating materials, and conductive coating films	2020-12-24
JP-6850936-B1	Conductive pigment pastes, coating materials, and conductive coating films	2020-12-24
CN-114075221-A	Substituted heteroaryl compounds, compositions and uses thereof	2020-08-13

The molarity calculator equation

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The dilution calculator equation

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This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBORONIC ACID

Product Information

Computed Properties

Patents

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