Basic information
- CAS
5486-67-9- Standard SMILES
Cc1ccc2nc(-c3ccncc3)cc(C(=O)O)c2c1- InChIKey
XLXSVFLOMPKIHG-UHFFFAOYSA-N- Molecular formula
- C16H12N2O2
- Average molar mass
- 264.28 g/mol
- Monoisotopic mass
- 264.08987763
Names & identifiers
- Preferred name
- Cinchoninic acid, 6-methyl-2-(4-pyridyl)-
- IUPAC
- 6-methyl-2-pyridin-4-ylquinoline-4-carboxylic acid
- English name
- 6-METHYL-2-PYRIDIN-4-YLQUINOLINE-4-CARBOXYLIC ACID
- Molecular formula
- C16H12N2O2
- Molecular weight
- 264.28
Names & synonyms
5486-67-96-Methyl-2-(4-pyridyl)cinchoninic acidCINCHONINIC ACID, 6-METHYL-2-(4-PYRIDYL)-6-Methyl-2-(4-pyridyl)cinchoninsaeure [German]6-Methyl-2-(4-pyridyl)cinchoninsaeureKyselin 6-metyl-2-(4-pyridyl)-cinchoninova [Czech]Kyselin 6-metyl-2-(4-pyridyl)-cinchoninovaDTXSID90203341RefChem:334149DTXCID901258326-methyl-2-pyridin-4-ylquinoline-4-carboxylic acid6-methyl-2-(pyridin-4-yl)quinoline-4-carboxylic acid
Show more names
SBB009297BAS 135176066-methyl-2-(4-pyridyl)-4-quinolinecarboxylic acid
MFCD002246906-Methyl-2-pyridin-4-yl-quinoline-4-carboxylic acid6-methyl-2-(4-pyridyl)quinoline-4-carboxylic acidOprea1_3163574-Quinolinecarboxylicacid, 6-methyl-2-(4-pyridinyl)-CHEMBL565905F3223-0019SCHEMBL2783593
Database identifiers
- CAS
5486-67-9- PubChem CID
- 21652
- DTXSID
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 63.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 354
Physicochemical properties
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310+P330-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310+P330-P405-P501
Chemistry & industry
Suppliers1 total
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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