6-Chloro-2-methyl-3-pyridineboronic Acid - CAS 913836-15-4
Catalog: |
BB040157 |
Product Name: |
6-Chloro-2-methyl-3-pyridineboronic Acid |
CAS: |
913836-15-4 |
Synonyms: |
(6-chloro-2-methyl-3-pyridinyl)boronic acid; (6-chloro-2-methylpyridin-3-yl)boronic acid |
IUPAC Name: | (6-chloro-2-methylpyridin-3-yl)boronic acid |
Description: | 6-Chloro-2-methyl-3-pyridineboronic Acid (CAS# 913836-15-4) is a useful research chemical. |
Molecular Weight: | 171.39 |
Molecular Formula: | C6H7ClNO2B |
Canonical SMILES: | B(C1=C(N=C(C=C1)Cl)C)(O)O |
InChI: | InChI=1S/C6H7BClNO2/c1-4-5(7(10)11)2-3-6(8)9-4/h2-3,10-11H,1H3 |
InChI Key: | WEKRUIAZOLIAOG-UHFFFAOYSA-N |
Boiling Point: | 336.6 °C at 760 mmHg |
Density: | 1.34 g/cm3 |
MDL: | MFCD07368875 |
LogP: | -0.27680 |
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 |
TW-201433567-A | Indazole derivatives | 20130228 |
JP-2014024838-A | A hypoglycemic agent containing a condensed heterocyclic compound as an active ingredient | 20120621 |
US-2015005232-A1 | Indazole derivatives | 20120302 |
US-9434743-B2 | Indazole derivatives | 20120302 |
WO-2013130855-A1 | Indazole derivatives | 20120302 |
Complexity: | 136 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.0258363 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.0258363 |
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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