Ethyl 7-Methoxyquinoline-3-carboxylate - CAS 71082-46-7
Catalog: |
BB065860 |
Product Name: |
Ethyl 7-Methoxyquinoline-3-carboxylate |
CAS: |
71082-46-7 |
Synonyms: |
ETHYL 7-METHOXYQUINOLINE-3-CARBOXYLATE; 3-ethoxycarbonyl-7-methoxyquinoline; ethyl 7-methoxy-3-quinolinecarboxylate |
IUPAC Name: | ethyl 7-methoxyquinoline-3-carboxylate |
Molecular Weight: | 231.25 |
Molecular Formula: | C13H13NO3 |
Canonical SMILES: | CCOC(=O)C1=CN=C2C=C(C=CC2=C1)OC |
InChI: | InChI=1S/C13H13NO3/c1-3-17-13(15)10-6-9-4-5-11(16-2)7-12(9)14-8-10/h4-8H,3H2,1-2H3 |
InChI Key: | MHONKQIXMNJTGY-UHFFFAOYSA-N |
Complexity: | 269 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 231.08954328 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 231.08954328 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 48.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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