4-Hydroxy-7-methoxyquinoline-3-carboxylic Acid - CAS 28027-17-0
Catalog: |
BB019741 |
Product Name: |
4-Hydroxy-7-methoxyquinoline-3-carboxylic Acid |
CAS: |
28027-17-0 |
Synonyms: |
7-methoxy-4-oxo-1H-quinoline-3-carboxylic acid; 7-methoxy-4-oxo-1H-quinoline-3-carboxylic acid |
IUPAC Name: | 7-methoxy-4-oxo-1H-quinoline-3-carboxylic acid |
Description: | 4-Hydroxy-7-methoxyquinoline-3-carboxylic Acid (CAS# 28027-17-0) is a useful research chemical. |
Molecular Weight: | 219.19 |
Molecular Formula: | C11H9NO4 |
Canonical SMILES: | COC1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)O |
InChI: | InChI=1S/C11H9NO4/c1-16-6-2-3-7-9(4-6)12-5-8(10(7)13)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15) |
InChI Key: | QROPNBKULZRDMD-UHFFFAOYSA-N |
Boiling Point: | 407.1 °C at 760 mmHg |
Density: | 1.402 g/cm3 |
MDL: | MFCD00024004 |
LogP: | 1.64720 |
Publication Number | Title | Priority Date |
AU-2008270630-A1 | Therapeutic compositions and the use thereof | 20070629 |
AU-2008270630-B2 | Therapeutic compositions and the use thereof | 20070629 |
JP-2010532372-A | Therapeutic compositions and uses thereof | 20070629 |
JP-2010532373-A | Therapeutic compositions and uses thereof | 20070629 |
JP-2013199494-A | Therapeutic compositions and uses thereof | 20070629 |
Complexity: | 350 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.05315777 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.05315777 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 75.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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