6-Bromopyridine-2-carboxylic acid - CAS 21190-87-4
Catalog: |
BB016674 |
Product Name: |
6-Bromopyridine-2-carboxylic acid |
CAS: |
21190-87-4 |
Synonyms: |
6-bromopyridine-2-carboxylic acid |
IUPAC Name: | 6-bromopyridine-2-carboxylic acid |
Description: | 6-Bromopyridine-2-carboxylic acid (CAS# 21190-87-4) is a useful research chemical. |
Molecular Weight: | 202.01 |
Molecular Formula: | C6H4BrNO2 |
Canonical SMILES: | C1=CC(=NC(=C1)Br)C(=O)O |
InChI: | InChI=1S/C6H4BrNO2/c7-5-3-1-2-4(8-5)6(9)10/h1-3H,(H,9,10) |
InChI Key: | XURXQNUIGWHWHU-UHFFFAOYSA-N |
Boiling Point: | 352.8 °C at 760 mmHg |
Melting Point: | 192-194 °C |
Purity: | 95 % |
Density: | 1.813 g/cm3 |
Appearance: | Light yellow cryst. |
MDL: | MFCD00093197 |
LogP: | 1.54230 |
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 |
WO-2021019051-A1 | Inhibitors of human atgl | 20190730 |
WO-2021007477-A1 | Indazoles and azaindazoles as lrrk2 inhibitors | 20190711 |
WO-2020184336-A1 | Liquid metal complex having oxygen-absorbing ability | 20190314 |
WO-2020150626-A1 | Imidazo[1,2-a]pyridinyl derivatives as irak4 inhibitors | 20190118 |
WO-2020043008-A1 | Pyrazole compounds, pharmaceutical compositions thereof and use thereof | 20180827 |
PMID | Publication Date | Title | Journal |
21189019 | 20110127 | Identifying chelators for metalloprotein inhibitors using a fragment-based approach | Journal of medicinal chemistry |
21522841 | 20110112 | Diaqua-(6-bromo-picolinato-κN,O)(nitrato-κO,O)copper(II) | Acta crystallographica. Section E, Structure reports online |
21578878 | 20091121 | 6-Bromo-pyridine-2-carboxamide | Acta crystallographica. Section E, Structure reports online |
21581517 | 20081210 | Aquabis-(6-bromo-picolinato-κN,O)copper(II) | Acta crystallographica. Section E, Structure reports online |
16842000 | 20060724 | Efficient energy conversion in photochromic ruthenium DMSO complexes | Inorganic chemistry |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 200.94254 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 200.94254 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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