Ethyl 4-Chloro-6-methylquinoline-3-carboxylate - CAS 56824-87-4
Catalog: |
BB029496 |
Product Name: |
Ethyl 4-Chloro-6-methylquinoline-3-carboxylate |
CAS: |
56824-87-4 |
Synonyms: |
4-chloro-6-methyl-3-quinolinecarboxylic acid ethyl ester; ethyl 4-chloro-6-methylquinoline-3-carboxylate |
IUPAC Name: | ethyl 4-chloro-6-methylquinoline-3-carboxylate |
Description: | Ethyl 4-Chloro-6-methylquinoline-3-carboxylate (CAS# 56824-87-4) is a useful research chemical. |
Molecular Weight: | 249.69 |
Molecular Formula: | C13H12ClNO2 |
Canonical SMILES: | CCOC(=O)C1=CN=C2C=CC(=CC2=C1Cl)C |
InChI: | InChI=1S/C13H12ClNO2/c1-3-17-13(16)10-7-15-11-5-4-8(2)6-9(11)12(10)14/h4-7H,3H2,1-2H3 |
InChI Key: | GSIDXMVQPNWNIR-UHFFFAOYSA-N |
Boiling Point: | 346.4 °C at 760 mmHg |
Density: | 1.252 g/cm3 |
MDL: | MFCD00173357 |
LogP: | 3.37330 |
Publication Number | Title | Priority Date |
CN-101143845-A | Substituted quinoline formyl guanidine derivative, its preparation method and medical use | 20071015 |
CN-101143845-B | Substituted quinoline formyl guanidine derivative, its preparation method and medical use | 20071015 |
AU-2008261888-A1 | Therapeutic pyrazoloquinoline urea derivatives | 20070608 |
CA-2688405-A1 | Therapeutic pyrazoloquinoline urea derivatives | 20070608 |
CN-101686682-A | therapeutic pyrazoloquinoline urea derivatives | 20070608 |
Complexity: | 285 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.0556563 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.0556563 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 39.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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