2,6-Dichloropyridine-4-boronic Acid - CAS 1072951-54-2
Catalog: |
BB002033 |
Product Name: |
2,6-Dichloropyridine-4-boronic Acid |
CAS: |
1072951-54-2 |
Synonyms: |
(2,6-dichloro-4-pyridinyl)boronic acid; (2,6-dichloropyridin-4-yl)boronic acid |
IUPAC Name: | (2,6-dichloropyridin-4-yl)boronic acid |
Description: | 2,6-Dichloropyridine-4-boronic Acid (CAS# 1072951-54-2) is used in preparation of orally bioavailable GPR40 agonists bearing thiophenylpropanoic acid scaffold for diabetes treatment. |
Molecular Weight: | 191.81 |
Molecular Formula: | C5H4Cl2NO2B |
Canonical SMILES: | B(C1=CC(=NC(=C1)Cl)Cl)(O)O |
InChI: | InChI=1S/C5H4BCl2NO2/c7-4-1-3(6(10)11)2-5(8)9-4/h1-2,10-11H |
InChI Key: | JFUQZFQJFYZZGY-UHFFFAOYSA-N |
Boiling Point: | 396.783 ℃ at 760 mmHg |
Density: | 1.567 g/cm3 |
Storage: | Inert atmosphere, Store in freezer, under -20 ℃ |
LogP: | 0.06820 |
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 |
CN-111018797-A | Organic compound, electronic element containing the same, and electronic device | 20191226 |
CN-111018797-B | Organic compound, electronic element containing the same, and electronic device | 20191226 |
KR-20200134984-A | An electroluminescent compound and an electroluminescent device comprising the same | 20190524 |
JP-2020191442-A | Organic electroluminescent device | 20190517 |
KR-20200132733-A | Organic electroluminescent element | 20190517 |
Complexity: | 128 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 190.9712139 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 190.9712139 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 53.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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