Quinoline-5-boronic Acid - CAS 355386-94-6
Catalog: |
BB022668 |
Product Name: |
Quinoline-5-boronic Acid |
CAS: |
355386-94-6 |
Synonyms: |
5-quinolinylboronic acid; quinolin-5-ylboronic acid |
IUPAC Name: | quinolin-5-ylboronic acid |
Description: | Quinoline-5-boronic Acid (CAS# 355386-94-6) is a useful research chemical. |
Molecular Weight: | 172.98 |
Molecular Formula: | C9H8NO2B |
Canonical SMILES: | B(C1=C2C=CC=NC2=CC=C1)(O)O |
InChI: | InChI=1S/C9H8BNO2/c12-10(13)8-4-1-5-9-7(8)3-2-6-11-9/h1-6,12-13H |
InChI Key: | NWIJBOCPTGHGIK-UHFFFAOYSA-N |
Boiling Point: | 400.3 °C at 760 mmHg |
Density: | 1.28 g/cm3 |
MDL: | MFCD03095058 |
LogP: | -0.08540 |
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-113121528-A | Multi-target inhibition compound, composition, functional molecule and application thereof | 20200115 |
JP-2021109862-A | Organic compounds and electrochromic devices | 20200115 |
WO-2021143729-A1 | Compound, composition and functional molecule with multi-target inhibiting effect and use thereof | 20200115 |
WO-2021138298-A1 | Malt1 modulators and uses thereof | 20191230 |
WO-2021023813-A1 | 5-heteroaryl-pyridin-2-amine confounds as neuropeptide ff receptor antagonists | 20190806 |
PMID | Publication Date | Title | Journal |
22484173 | 20120701 | Fluorometric determination of inulin using 5-quinolineboronic acid and inulinase | Analytical biochemistry |
21579363 | 20100508 | 3-Amino-phenyl-boronic acid monohydrate | Acta crystallographica. Section E, Structure reports online |
Complexity: | 177 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 173.0648087 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 173.0648087 |
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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