4-Iodophenylboronic acid pinacol ester
Product Information
Molecular Formula
C12H16BIO2
Molecular Weight
329.97
Description
4-Iodophenylboronic acid pinacol ester is a compound of utmost importance in the biomedical domain that functions as a critical constituent in the synthesis of pharmaceutical medications, particularly in the management of diverse ailments. Demonstrating remarkable adaptability, it serves as a fundamental foundation for the creation of targeted therapeutic interventions and drug transport mechanisms, thereby augmenting the efficacy and selectivity of treatment modalities.
Synonyms
2-(4-Iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC Name
2-(4-iodophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)I
InChI
InChI=1S/C12H16BIO2/c1-11(2)12(3,4)16-13(15-11)9-5-7-10(14)8-6-9/h5-8H,1-4H3
InChI Key
ACCWXFPZHMACEN-UHFFFAOYSA-N
Melting Point
101-105 °C
Flash Point
Not applicable
Purity
97%
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
330.02881 g/mol
Monoisotopic Mass
330.02881 g/mol
Topological Polar Surface Area
18.5Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
244
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 |
|---|---|---|
| US-2020361939-A1 | Modulators of alpha-1 antitrypsin | 2019-05-14 |
| WO-2020247160-A1 | Condensed tryciclic pyrroles as alpha-1 antitrypsin modulators | 2019-05-14 |
| TW-202108588-A | Modulators of alpha-1 antitrypsin | 2019-05-14 |
| AU-2020286424-A1 | Condensed tricyclic pyrroles as alpha-1 antitrypsin Modulators | 2019-05-14 |
| CN-114096542-A | Condensed tricyclic pyrroles as alpha-1 antitrypsin modulators | 2019-05-14 |
| WO-2019154412-A1 | Compound acting as antibiotics | 2018-02-10 |
| JP-2021513543-A | Antibacterial compound | 2018-02-10 |
| CN-110612296-A | Phenyl derivatives as PGE2 receptor modulators | 2017-05-18 |
| CN-110612299-A | Pyrimidine derivatives as PGE2 receptor modulators | 2017-05-18 |
| CN-110621667-A | Pyrimidine derivatives | 2017-05-18 |
