2,6-Dichloropyridine-4-boronic Acid Pinacol Ester
Product Information
Molecular Formula
C11H14Cl2NO2B
Molecular Weight
273.95
Description
2,6-Dichloropyridine-4-boronic Acid Pinacol Ester (CAS# 408492-27-3) is a useful research chemical.
Synonyms
2,6-dichloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine; 2,6-dichloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
IUPAC Name
2,6-dichloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=NC(=C2)Cl)Cl
InChI
InChI=1S/C11H14BCl2NO2/c1-10(2)11(3,4)17-12(16-10)7-5-8(13)15-9(14)6-7/h5-6H,1-4H3
InChI Key
PEFDHAOFDBNZEQ-UHFFFAOYSA-N
Boiling Point
373.232 °C at 760 mmHg
Melting Point
117-119 °C
Flash Point
Not applicable
Purity
95 %
Density
1.244 g/cm3
Storage
2-8 °C
LogP
2.68760
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
3
Rotatable Bond Count
1
Exact Mass
273.0494642 g/mol
Monoisotopic Mass
273.0494642 g/mol
Topological Polar Surface Area
31.4Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
275
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 |
|---|---|---|
| WO-2022023772-A1 | Antagonist compounds | 2020-07-31 |
| WO-2020255022-A1 | Combination of hepatitis b virus (hbv) vaccines and aminopyridine derivatives as hpk1 inhibitors | 2019-06-18 |
| WO-2020193511-A1 | Hpk1 inhibitors | 2019-03-26 |
| TW-202102488-A | Hpk1 inhibitors | 2019-03-26 |
| AU-2020249409-A1 | HPK1 inhibitors | 2019-03-26 |
| CA-3129768-A1 | Hpk1 inhibitors | 2019-03-26 |
| EP-3947366-A1 | Hpk1 inhibitors | 2019-03-26 |
| CN-111377852-A | Derivative and organic EL element using same | 2018-12-28 |
| JP-2020105131-A | Chrysene derivative and organic EL device using the same | 2018-12-28 |
| CN-112189012-A | Trisubstituted aryl and heteroaryl derivatives as modulators of PI3 kinase and autophagy pathways | 2018-04-10 |
