3-Fluoropyridine-4-boronic Acid Pinacol Ester
Product Information
Molecular Formula
C11H15FNO2B
Molecular Weight
223.05
Description
3-Fluoropyridine-4-boronic Acid Pinacol Ester (CAS# 458532-88-2) is a useful research chemical.
Synonyms
3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
IUPAC Name
3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C(C=NC=C2)F
InChI
InChI=1S/C11H15BFNO2/c1-10(2)11(3,4)16-12(15-10)8-5-6-14-7-9(8)13/h5-7H,1-4H3
InChI Key
MLFGHAHGSVFKMI-UHFFFAOYSA-N
Boiling Point
292.4 °C at 760 mmHg
Melting Point
124-128 °C
Flash Point
Not applicable
Purity
95 %
Density
1.09 g/cm3
LogP
1.51990
Safety Information
Hazards
H315 - H319 - H335
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
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
1
Exact Mass
223.1179870 g/mol
Monoisotopic Mass
223.1179870 g/mol
Topological Polar Surface Area
31.4Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
257
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-2021261587-A1 | STRAD-binding agents and Uses Thereof | 2020-01-30 |
| WO-2020259601-A1 | Substituted fused heteroaromatic bicyclic compounds as kinase inhibitors and the use thereof | 2019-06-28 |
| CN-112955441-A | Functionalized aminotriazines | 2018-10-24 |
| JP-2022509388-A | Functionalized aminotriazine | 2018-10-24 |
| US-2021395225-A1 | Functionalized aminotriazines | 2018-10-24 |
| WO-2020079173-A1 | Pyridylphenylaminoquinolines and analogues | 2018-10-18 |
| BR-112021007312-A2 | pyridylphenylaminoquinolines and analogues | 2018-10-18 |
| CN-112996782-A | Pyridylphenylaminoquinolines and analogs | 2018-10-18 |
| EP-3867241-A1 | Pyridylphenylaminoquinolines and analogues | 2018-10-18 |
| KR-20210081370-A | Pyridylphenylaminoquinoline and analogs | 2018-10-18 |
