Methyl Quinoline-4-carboxylate - CAS 21233-61-4
Catalog: |
BB016720 |
Product Name: |
Methyl Quinoline-4-carboxylate |
CAS: |
21233-61-4 |
Synonyms: |
4-quinolinecarboxylic acid methyl ester; methyl quinoline-4-carboxylate |
IUPAC Name: | methyl quinoline-4-carboxylate |
Description: | Methyl Quinoline-4-carboxylate (CAS# 21233-61-4) is a useful research chemical. |
Molecular Weight: | 187.19 |
Molecular Formula: | C11H9NO2 |
Canonical SMILES: | COC(=O)C1=CC=NC2=CC=CC=C12 |
InChI: | InChI=1S/C11H9NO2/c1-14-11(13)9-6-7-12-10-5-3-2-4-8(9)10/h2-7H,1H3 |
InChI Key: | KPZUGRPXEZGEGE-UHFFFAOYSA-N |
Boiling Point: | 303.2 ℃ at 760 mmHg |
Density: | 1.21 g/cm3 |
LogP: | 2.02140 |
Publication Number | Title | Priority Date |
CN-112358479-A | Synthesis method of pyrrolo [3,4-c ] quinoline-1, 3-diketone compound | 20201228 |
WO-2020135771-A1 | Heterocyclic compound intermediate, preparation method therefor and application thereof | 20181229 |
EP-3630770-A1 | Pyrazolo[3,4-b]pyrazine derivatives as shp2 phosphatase inhibitors | 20170526 |
US-2020172546-A1 | Pyrazolo[3,4-b]pyrazine derivatives as shp2 phosphatase inhibitors | 20170526 |
WO-2018218133-A1 | Pyrazolo[3,4-b]pyrazine derivatives as shp2 phosphatase inhibitors | 20170526 |
PMID | Publication Date | Title | Journal |
15246094 | 20040801 | Synthesis and antimycobacterial activities of ring-substituted quinolinecarboxylic acid/ester analogues. Part 1 | Bioorganic & medicinal chemistry |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.06332853 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 39.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.8 |
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