5,8-Dimethylquinoline-3-carboxylic acid - CAS 763893-29-4
Catalog: |
BB035562 |
Product Name: |
5,8-Dimethylquinoline-3-carboxylic acid |
CAS: |
763893-29-4 |
Synonyms: |
5,8-dimethylquinoline-3-carboxylic acid |
IUPAC Name: | 5,8-dimethylquinoline-3-carboxylic acid |
Description: | 5,8-Dimethylquinoline-3-carboxylic acid (CAS# 763893-29-4) is a useful research chemical. |
Molecular Weight: | 201.22 |
Molecular Formula: | C12H11NO2 |
Canonical SMILES: | CC1=C2C=C(C=NC2=C(C=C1)C)C(=O)O |
InChI: | InChI=1S/C12H11NO2/c1-7-3-4-8(2)11-10(7)5-9(6-13-11)12(14)15/h3-6H,1-2H3,(H,14,15) |
InChI Key: | MXKOVYWLTMCDMM-UHFFFAOYSA-N |
Boiling Point: | 373.9 °C at 760 mmHg |
Density: | 1.243 g/cm3 |
LogP: | 2.54980 |
Publication Number | Title | Priority Date |
TW-200418473-A | Methods of using CCR1 antagonists as immunomodulatory agents | 20021030 |
US-2004087571-A1 | Methods of using CCR1 antagonists as immunomodulatory agents | 20021030 |
US-2002198207-A1 | Novel Hexanoic acid derivatives | 20000518 |
CZ-9902904-A3 | Derivatives of heteroarylhexanoic acid amides, pharmaceutical compositions based thereon and treatment or prevention methods | 19980205 |
AP-1056-A | Novel hexanoic acid derivatives. | 19970226 |
Complexity: | 254 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.078978594 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.078978594 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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Quinoline/Isoquinoline
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