Basic information
- CAS
588679-49-6- Standard SMILES
COc1ccc2nc(-c3ccc(C)o3)cc(C(=O)O)c2c1- InChIKey
OXBVROWWURYIFD-UHFFFAOYSA-N- Molecular formula
- C16H13NO4
- Average molar mass
- 283.28 g/mol
Names & identifiers
- Preferred name
- 6-Methoxy-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid
- IUPAC
- 6-methoxy-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid
- English name
- 6-methoxy-2-(5-methyl-2-furyl)quinoline-4-carboxylic acid
- Molecular formula
- C16H13NO4
- Molecular weight
- 283.28
Names & synonyms
588679-49-66-methoxy-2-(5-methylfuran-2-yl)quinoline-4-carboxylic acid6-methoxy-2-(5-methyl-2-furyl)quinoline-4-carboxylic AcidMFCD039440584-quinolinecarboxylic acid, 6-methoxy-2-(5-methyl-2-furanyl)-Oprea1_054465ALBB-011650BBL013729STK333731AKOS003330551VS-03970ST50843389
Show more names
6-methoxy-2-(5-methyl-2-furyl)cinchoninic acid6-methoxy-2-(5-methyl-2-furyl)-4-quinolinecarboxylic acid4-quinolinecarboxylic acid, 6-methoxy-2-(5-methyl-2-furany
H266186-methoxy-2-(5-methylfuran-2-yl)quinoline-4-carboxylicacid6-methoxy-2-(5-methyl(2-furyl))quinoline-4-carboxylic acid
Database identifiers
- CAS
588679-49-6
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 388
Physicochemical properties
- HazardClass
- IRRITANT
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
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers2 total
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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