≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships 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(C2=C(C3=CC=CC=C3N1)C4(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)C |
|---|---|
| IUPAC Name | tetramethyl 5',5'-dimethylspiro[1,3-dithiole-2,1'-6H-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate |
| InChIKey | LXJGCBLKKKPLSY-UHFFFAOYSA-N |
| INCHI | 1S/C24H23NO8S3/c1-23(2)18-13(11-9-7-8-10-12(11)25-23)24(14(19(26)30-3)15(34-18)20(27)31-4)35-16(21(28)32-5)17(36-24)22(29)33-6/h7-10,25H,1-6H3 |
| Isomeric SMILES | CC1(C2=C(C3=CC=CC=C3N1)C4(C(=C(S2)C(=O)OC)C(=O)OC)SC(=C(S4)C(=O)OC)C(=O)OC)C |
| PubChem CID | 2835221 |
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 | Quinolones and derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Thiopyranoquinolines |
| Alternative Parents | Pyranoquinolines Tetracarboxylic acids and derivatives Hydroquinolones Hydroquinolines Dithioketals Secondary alkylarylamines Thiopyrans Vinylogous thioesters Benzenoids Pyrans Methyl esters Enoate esters 1,3-dithioles Thioenol ethers Amino acids and derivatives Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Pyranoquinoline - Thiopyranoquinoline - Tetracarboxylic acid or derivatives - Dihydroquinolone - Dihydroquinoline - Dithioketal - Secondary aliphatic/aromatic amine - Vinylogous thioester - Pyran - Thiopyran - Benzenoid - 1,3-dithiole - Methyl ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Dithiole - Thioacetal - Thioenolether - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Azacycle - Carboxylic acid derivative - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as thiopyranoquinolines. These are polycyclic compounds containing a thiopyran ring fused to a quinoline moiety. Quinoline or benzo[b]pyridine is a bicyclic compound that consists of benzene fused to a pyridine. |
| External Descriptors | Not available |
| Molecular Weight | 549.600 g/mol |
|---|---|
| XLogP3 | 3.400 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 8 |
| Exact Mass | 549.059 Da |
| Monoisotopic Mass | 549.059 Da |
| Topological Polar Surface Area | 193.000 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 1090.000 |
| 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 |
![Tetramethyl 5',5'-dimethyl-5',6'-dihydrospiro[1,3-dithiole-2,1'-thiopyrano[2,3-c]quinoline]-2',3',4,5-tetracarboxylate - ≥95% , CAS No.258267-22-0](https://www.aladdinsci.com/media/catalog/product/placeholder/default/default_4.jpg)