Methyl picolinate - CAS 2459-07-6
Catalog: |
BB018538 |
Product Name: |
Methyl picolinate |
CAS: |
2459-07-6 |
Synonyms: |
2-Pyridinecarboxylic acid, methyl ester; Picolinic acid, methyl ester; 2-(Methoxycarbonyl)pyridine; 2-Carbomethoxypyridine; 2-Picolinic acid methyl ester; Methyl 2-pyridinecarboxylate; NSC 1459 |
IUPAC Name: | methyl pyridine-2-carboxylate |
Molecular Weight: | 137.14 |
Molecular Formula: | C7H7NO2 |
Canonical SMILES: | COC(=O)C1=CC=CC=N1 |
InChI: | InChI=1S/C7H7NO2/c1-10-7(9)6-4-2-3-5-8-6/h2-5H,1H3 |
InChI Key: | NMMIHXMBOZYNET-UHFFFAOYSA-N |
Boiling Point: | 112°C at 13 Torr |
Melting Point: | 18.7°C |
Purity: | 95% |
Density: | 1.137±0.06 g/cm3 |
Appearance: | Clear to slightly yellow liquid |
MDL: | MFCD00038038 |
LogP: | 0.86820 |
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-112439405-A | Catalyst for preparing dimethyl carbonate from methanol, carbon dioxide and 2-cyanopyridine and preparation method and application thereof | 20201221 |
CN-112062909-A | Pyridine ring-containing acylhydrazone Schiff base metal complex hydrogel and preparation method and application thereof | 20200831 |
CN-112062909-B | Pyridine ring-containing acylhydrazone Schiff base metal complex hydrogel and preparation method and application thereof | 20200831 |
CN-111769203-A | TiO for polymer planarization treatment2Scattering film material and preparation method and application thereof | 20200618 |
CN-113429410-A | Polyheterocyclic substituted pyrimidine or pyridylamine derivatives, compositions and medical uses thereof | 20200323 |
PMID | Publication Date | Title | Journal |
22378230 | 20120414 | Bismuth 2,6-pyridinedicarboxylates: assembly of molecular units into coordination polymers, CO2 sorption and photoluminescence | Dalton transactions (Cambridge, England : 2003) |
19272778 | 20090401 | First asymmetric synthesis of CJ-14877 and its enantiomer and their interleukin-1beta inhibitory activities | Bioorganic & medicinal chemistry letters |
16574471 | 20061101 | Multinuclear NMR spectroscopic and theoretical study on the interactions between diperoxovanadate complex and picoline-like ligands | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
16254941 | 20051201 | Design of a hairpin polyamide, ZT65B, for targeting the inverted CCAAT box (ICB) site in the multidrug resistant (MDR1) gene | Chembiochem : a European journal of chemical biology |
Complexity: | 125 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.047678466 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.047678466 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 39.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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