4-Picolinic Acid Ethyl Ester - CAS 1570-45-2
Catalog: |
BB011286 |
Product Name: |
4-Picolinic Acid Ethyl Ester |
CAS: |
1570-45-2 |
Synonyms: |
4-pyridinecarboxylic acid ethyl ester; ethyl pyridine-4-carboxylate |
IUPAC Name: | ethyl pyridine-4-carboxylate |
Description: | 4-Picolinic Acid Ethyl Ester (CAS# 1570-45-2) is an organic building block, used in the synthesis of various pharmaceutical and biologically active compounds. It is also a pyridine compound that is shown to be able to trap the thrips in the corp. |
Molecular Weight: | 151.16 |
Molecular Formula: | C8H9NO2 |
Canonical SMILES: | CCOC(=O)C1=CC=NC=C1 |
InChI: | InChI=1S/C8H9NO2/c1-2-11-8(10)7-3-5-9-6-4-7/h3-6H,2H2,1H3 |
InChI Key: | MCRPKBUFXAKDKI-UHFFFAOYSA-N |
Boiling Point: | 92 °C (8 mmHg) |
Density: | 1.009 g/cm3 |
MDL: | MFCD00006428 |
LogP: | 1.25830 |
GHS Hazard Statement: | H315 (91.3%): 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-112387312-A | Preparation method of MOF-confinement-based supported gold nanoparticle catalyst | 20201102 |
CN-111559975-A | Continuous synthesis method and application of piperidine-4-ethyl formate | 20200715 |
CN-111559975-B | Continuous synthesis method and application of piperidine-4-ethyl formate | 20200715 |
CN-111662554-A | Polyacetal composition and preparation method and application thereof | 20200713 |
CN-111732537-A | Preparation method of isoniazid | 20200703 |
PMID | Publication Date | Title | Journal |
22719337 | 20120601 | Tetra-kis(ethyl pyridine-4-carboxyl-ate-κN)bis-(thio-cyanato-κN)cobalt(II) | Acta crystallographica. Section E, Structure reports online |
22346870 | 20120201 | Chloridobis(dimethyl-glyoximato-κN,N')(ethyl pyridine-4-carboxyl-ate-κN)cobalt(III) chloro-form monosolvate | Acta crystallographica. Section E, Structure reports online |
19900838 | 20100101 | Multinuclear NMR and theoretical investigation on interactions between diperoxovanadate complex and 4-picoline-like ligands | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
19736758 | 20090801 | Pyridine compounds increase thrips (Thysanoptera: Thripidae) trap capture in an onion crop | Journal of economic entomology |
19054708 | 20090301 | Synthesis, crystal structure, EPR spectra of doped VO(2+) and Cu(2+) ions in [Zn(ethylisonicotinate)(2)(H(2)O)(4)].(sac)(2) single crystal | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 151.063328530 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 151.063328530 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 39.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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