4-METHOXY-2-(TRIFLUOROMETHYL)PHENYLBORONIC ACID
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
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
2
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
2
Exact Mass
220.0518588 g/mol
Monoisotopic Mass
220.0518588 g/mol
Topological Polar Surface Area
49.7Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
210
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
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 |
