6-Fluoro-2-methylquinoline-3-carboxylic acid
Basic information
- CAS
461026-47-1- Standard SMILES
Cc1nc2ccc(F)cc2cc1C(=O)O- InChIKey
ZPRUQEILFHQVHS-UHFFFAOYSA-N- Molecular formula
- C11H8FNO2
- Average molar mass
- 205.18 g/mol
- Monoisotopic mass
- 205.05390666
Names & identifiers
- Preferred name
- 6-Fluoro-2-methylquinoline-3-carboxylic acid
- IUPAC
- 6-fluoro-2-methylquinoline-3-carboxylic acid
- English name
- 6-Fluoro-2-methylquinoline-3-carboxylic acid
- Molecular formula
- C11H8FNO2
- Molecular weight
- 205.19
Names & synonyms
6-fluoro-2-methylquinoline-3-carboxylic acid461026-47-16-Fluoro-2-methyl-quinoline-3-carboxylic acidC11H8FNO2MFCD03085774F1371-01926-fluoro-2-methyl-3-quinolinecarboxylic acid3990AEOTAVA-BB BB7110950225ChemDiv2_001204Oprea1_275175Oprea1_280455
Show more names
AKOS A0801-0046AKOS BBS-00001334OTAVA-BB 7110950225IFLAB-BB F1371-01923-Quinolinecarboxylic acid, 6-fluoro-2-methyl-
AURORA 23207orb3029615SCHEMBL2423281TIMTEC-BB SBB011096DTXSID30351178ZPRUQEILFHQVHS-UHFFFAOYSA-NHMS1372G16SMSSF-0040579
Database identifiers
- CAS
461026-47-1- PubChem CID
- 693108
- DTXSID
DTXSID30351178
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 50.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- storage temp.
- Store at room temperature
- Appearance
- Off-white to yellow Solid
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2933499090 · 2933499090
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
- hs_code
- 2933499090
- hazard_code
- Xi
- hazard_class
- IRRITANT
Suppliers
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Related reactions
2 records
Compound notes
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