Determine the necessary mass, volume, or concentration for preparing a solution.
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≥99%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | CC1=C2C(=C3C=C(C=CC3=NC2=NN1)OC)NCCOCCO |
|---|---|
| IUPAC Name | 2-[2-[(6-methoxy-3-methyl-2H-pyrazolo[3,4-b]quinolin-4-yl)amino]ethoxy]ethanol |
| InChIKey | YWEGXZZAORIRQR-UHFFFAOYSA-N |
| INCHI | 1S/C16H20N4O3/c1-10-14-15(17-5-7-23-8-6-21)12-9-11(22-2)3-4-13(12)18-16(14)20-19-10/h3-4,9,21H,5-8H2,1-2H3,(H2,17,18,19,20) |
| Isomeric SMILES | CC1=C2C(=C3C=C(C=CC3=NC2=NN1)OC)NCCOCCO |
| PubChem CID | 9995890 |
| Molecular Weight | 316.35 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Quinolines and derivatives |
| Subclass | Aminoquinolines and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | 4-aminoquinolines |
| Alternative Parents | Pyrazolopyridines Anisoles Secondary alkylarylamines Aminopyridines and derivatives Alkyl aryl ethers Pyrazoles Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Primary alcohols Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 4-aminoquinoline - Pyrazolopyridine - Anisole - Alkyl aryl ether - Aminopyridine - Secondary aliphatic/aromatic amine - Pyridine - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Ether - Dialkyl ether - Azacycle - Secondary amine - Hydrocarbon derivative - Organic nitrogen compound - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as 4-aminoquinolines. These are organic compounds containing an amino group attached to the 4-position of a quinoline ring system. |
| External Descriptors | aromatic ether - secondary amino compound - primary alcohol - aromatic amine - pyrazoloquinoline |
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| Solubility | Solvent:DMSO, Max Conc. mg/mL: 31.64, Max Conc. mM: 100 |
|---|---|
| Molecular Weight | 316.350 g/mol |
| XLogP3 | 1.700 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 316.154 Da |
| Monoisotopic Mass | 316.154 Da |
| Topological Polar Surface Area | 92.300 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 373.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |