2-Methylpyridine-4-boronic Acid - CAS 579476-63-4
Catalog: |
BB029875 |
Product Name: |
2-Methylpyridine-4-boronic Acid |
CAS: |
579476-63-4 |
Synonyms: |
(2-methyl-4-pyridinyl)boronic acid; (2-methylpyridin-4-yl)boronic acid |
IUPAC Name: | (2-methylpyridin-4-yl)boronic acid |
Description: | 2-Methylpyridine-4-boronic Acid (CAS# 579476-63-4) is used as a reagent in the preparation of dihydro-phenylquinazlinone derivatives as encephalitic alphaviruses inhibitors useful in the treatment of viral infections. |
Molecular Weight: | 136.94 |
Molecular Formula: | C6H8NO2B |
Canonical SMILES: | B(C1=CC(=NC=C1)C)(O)O |
InChI: | InChI=1S/C6H8BNO2/c1-5-4-6(7(9)10)2-3-8-5/h2-4,9-10H,1H3 |
InChI Key: | UFYBTLOLWSABAU-UHFFFAOYSA-N |
Boiling Point: | 311.2 °C at 760 mmHg |
Density: | 1.18 g/cm3 |
MDL: | MFCD03095364 |
LogP: | -0.93020 |
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-113493452-A | WNT pathway inhibitor | 20200407 |
WO-2021203025-A1 | 1 h-pyrazolo[4,3-g]isoquinoline and 1 h-pyrazolo[4,3-g]quinoline derivatives as alpha-1 -antitrypsin modulators for treating alpha-1 -antitrypsin deficiency (aatd) | 20200403 |
WO-2021203028-A1 | 7- or 8-hydroxy-isoquinoline and 7- or 8-hydroxy-quinoline derivatives as alpha-1 -antitrypsin modulators for treating alpha-1 -antitrypsin deficiency (aatd) | 20200403 |
WO-2021201036-A1 | Hydroxypyrrolidine derivative and medicinal application thereof | 20200331 |
WO-2021195066-A2 | Kcnt1 inhibitors and methods of use | 20200323 |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.0648087 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.0648087 |
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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