8-Fluoro-2-methylquinoline-4-carboxylic acid
Basic information
- CAS
288151-68-8- Standard SMILES
Cc1cc(C(=O)O)c2cccc(F)c2n1- InChIKey
FJAJACPHCDNIBI-UHFFFAOYSA-N- Molecular formula
- C11H8FNO2
- Average molar mass
- 205.18 g/mol
- Monoisotopic mass
- 205.05390666
Names & identifiers
- Preferred name
- 8-Fluoro-2-methylquinoline-4-carboxylic acid
- IUPAC
- 8-fluoro-2-methylquinoline-4-carboxylic acid
- English name
- 4-Quinolinecarboxylic acid, 8-fluoro-2-Methyl-
- Molecular formula
- C11H8FNO2
- Molecular weight
- 205.19
Names & synonyms
8-fluoro-2-methylquinoline-4-carboxylic acid288151-68-8MFCD051754514-Quinolinecarboxylic acid, 8-fluoro-2-methyl-8-Fluoro-2-methylquinoline-4-carboxylicacid8-fluoro-2-methyl-4-quinolinecarboxylic acid8-fluoro-2-methyl-quinoline-4-carboxylic AcidSCHEMBL6588813DTXSID80393609AKOS015897233SB71484AS-66912
Show more names
SY502216DB-333838CS-0152749C74481AP-501/43379916F322460
Database identifiers
- CAS
288151-68-8- PubChem CID
- 3556530
- DTXSID
DTXSID80393609
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
- Boiling point
- 348 · 348.0±37.0 °C(Predicted)
- Density
- 1.369 · 1.369±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.24 · 3.24±0.50(Predicted)
- Appearance
- Off-white to light yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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