7-Chloro-2-methyl-quinoline-3-carboxylic acid - CAS 171270-39-6
Catalog: |
BB012731 |
Product Name: |
7-Chloro-2-methyl-quinoline-3-carboxylic acid |
CAS: |
171270-39-6 |
Synonyms: |
7-chloro-2-methylquinoline-3-carboxylic acid |
IUPAC Name: | 7-chloro-2-methylquinoline-3-carboxylic acid |
Description: | 7-Chloro-2-methyl-quinoline-3-carboxylic acid (CAS# 171270-39-6) is a useful research chemical. |
Molecular Weight: | 221.64 |
Molecular Formula: | C11H8ClNO2 |
Canonical SMILES: | CC1=C(C=C2C=CC(=CC2=N1)Cl)C(=O)O |
InChI: | InChI=1S/C11H8ClNO2/c1-6-9(11(14)15)4-7-2-3-8(12)5-10(7)13-6/h2-5H,1H3,(H,14,15) |
InChI Key: | MBUYIVCGUGFJFH-UHFFFAOYSA-N |
Boiling Point: | 374.9 °C at 760 mmHg |
Density: | 1.406 g/cm3 |
LogP: | 2.89480 |
Publication Number | Title | Priority Date |
EP-2024272-A2 | Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same | 20060510 |
JP-2009536657-A | Amide derivatives as ion channel ligands and pharmaceutical compositions and methods using the same | 20060510 |
US-2012088746-A1 | Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same | 20060510 |
WO-2007133637-A2 | Amide derivatives as ion-channel ligands and pharmaceutical compositions and methods of using the same | 20060510 |
HU-212967-B | Process for producing 7-chloro-quinaldine | 19921228 |
Complexity: | 259 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.0243562 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.0243562 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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