2,3-Dichloropyridine-4-boronic Acid
Product Information
Molecular Formula
C5H4BCl2NO2
Molecular Weight
191.80
Description
2,3-Dichloropyridine-4-boronic Acid (CAS# 951677-39-7) is a useful research chemical.
Synonyms
(2,3-dichloro-4-pyridinyl)boronic acid; (2,3-dichloropyridin-4-yl)boronic acid
IUPAC Name
(2,3-dichloropyridin-4-yl)boronic acid
SMILES
B(C1=C(C(=NC=C1)Cl)Cl)(O)O
InChI
InChI=1S/C5H4BCl2NO2/c7-4-3(6(10)11)1-2-9-5(4)8/h1-2,10-11H
InChI Key
ABRTZUPJNVJMHP-UHFFFAOYSA-N
Boiling Point
375.7 °C at 760 mmHg
Flash Point
Not applicable
Density
1.56 g/cm3
LogP
0.06820
Safety Information
Hazards
H302
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
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
1
Exact Mass
190.9712139 g/mol
Monoisotopic Mass
190.9712139 g/mol
Topological Polar Surface Area
53.4Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
138
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-2021403449-A1 | Biphenyl diaryl pyrimidine derivative with aromatic heterocyclic structure | 2021-03-08 |
| WO-2021115335-A1 | Compound as cyclin-dependent kinase 9 inhibitor and use thereof | 2019-12-09 |
| WO-2021043077-A1 | Substituted pyrazine compound and preparation method therefor and use thereof | 2019-09-06 |
| CN-114127053-A | Substituted pyrazine compound, preparation method and application thereof | 2019-09-06 |
| WO-2020249079-A1 | Shp2 phosphatase allosteric inhibitor | 2019-06-14 |
| TW-202112761-A | SHP2 Phosphatase Allosteric Inhibitor | 2019-06-14 |
| CN-114008035-A | SHP2 phosphatase allosteric inhibitor | 2019-06-14 |
| CN-111484491-A | Substituted pyrido-cyclic compounds, process for their preparation and their use | 2019-01-25 |
| WO-2020108590-A1 | Pyrimidine and five-membered nitrogen heterocycle derivative, preparation method therefor, and medical uses thereof | 2018-11-30 |
| TW-202039498-A | Pyrimidine five-membered nitrogen heterocyclic derivatives, a preparation method thereof and pharmaceutical use thereof | 2018-11-30 |
