8-Fluoro-3-hydroxy-2-methylquinoline-4-carboxylic acid
Basic information
- CAS
1565780-80-4- Standard SMILES
Cc1nc2c(F)cccc2c(C(=O)O)c1O- InChIKey
WSFHKUPNCZJNOL-UHFFFAOYSA-N- Molecular formula
- C11H8FNO3
- Average molar mass
- 221.18 g/mol
- Monoisotopic mass
- 221.04882128
Names & identifiers
- Preferred name
- 8-Fluoro-3-hydroxy-2-methylquinoline-4-carboxylic acid
- IUPAC
- 8-fluoro-3-hydroxy-2-methylquinoline-4-carboxylic acid
Names & synonyms
8-fluoro-3-hydroxy-2-methylquinoline-4-carboxylic acid1565780-80-4RefChem:548067857-284-18-fluoro-3-hydroxy-2-methylquinoline-4-carboxylicacidSCHEMBL15491689AKOS032953136EN300-7539764Z2982226705
Database identifiers
- CAS
1565780-80-4- PubChem CID
- 89983236
- EC Number
- 857-284-1
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 286
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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