3-Fluoropyridine-4-boronic Acid Pinacol Ester - CAS 458532-88-2
Catalog: |
BB025999 |
Product Name: |
3-Fluoropyridine-4-boronic Acid Pinacol Ester |
CAS: |
458532-88-2 |
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 |
Description: | 3-Fluoropyridine-4-boronic Acid Pinacol Ester (CAS# 458532-88-2) is a useful research chemical. |
Molecular Weight: | 223.05 |
Molecular Formula: | C11H15FNO2B |
Canonical 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 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
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 |
Publication Number | Title | Priority Date |
US-2021261587-A1 | STRAD-binding agents and Uses Thereof | 20200130 |
WO-2020259601-A1 | Substituted fused heteroaromatic bicyclic compounds as kinase inhibitors and the use thereof | 20190628 |
CN-112955441-A | Functionalized aminotriazines | 20181024 |
WO-2020079173-A1 | Pyridylphenylaminoquinolines and analogues | 20181018 |
CN-112996782-A | Pyridylphenylaminoquinolines and analogs | 20181018 |
Complexity: | 257 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 223.1179870 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 223.1179870 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 31.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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