6-Fluoroquinolin-4-ol

C₉H₆FNOCAS 391-78-6163.15 g/mol

Open in Covalent MOL file

Aryl halide

Properties

Molecular formula: C₉H₆FNO
Molar mass: 163.15 g/mol
Exact mass: 163.0433 Da
logP: 1.67Crippen estimate
Polar surface area: 32.9 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed33.3% of notifiers
H315 Causes skin irritation66.7% of notifiers
H319 Causes serious eye irritation66.7% of notifiers
H335 May cause respiratory irritation66.7% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

391-78-6

SMILES

C1=CC2=C(C=C1F)C(=O)C=CN2

InChIKey

BYZXOYSEYWCLOK-UHFFFAOYSA-N

InChI

InChI=1S/C9H6FNO/c10-6-1-2-8-7(5-6)9(12)3-4-11-8/h1-5H,(H,11,12)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

6-Fluoro-4-hydroxyquinoline

Work with 6-Fluoroquinolin-4-ol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6-Bromo-4-hydroxyquinoline145369-94-459 % similar 6-(Trifluoromethyl)-4-quinolinol49713-51-158 % similar 6-(Trifluoromethoxy)-4-quinolinol175203-87-955 % similar 6-Fluoro-2-methylquinolin-4-ol15912-68-254 % similar 5-Fluoroindole399-52-053 % similar 4-Hydroxyquinoline611-36-953 % similar 6-Fluoro-4-hydroxy-2-(trifluoromethyl)quinoline31009-34-451 % similar 6-Fluoroindole399-51-948 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-(4-Fluorophenyl)oxazole128101-19-9 3-(3-Fluorophenyl)-3-oxopropanenitrile21667-61-8 5-Fluoro-1H-indole-3-carbaldehyde2338-71-8 6-Fluoroindole-3-carboxaldehyde2795-41-7 3-(2-Fluorophenyl)-3-oxopropionitrile31915-26-1 5-Fluoro-8-quinolinol387-97-3 4-Fluoro-β-oxobenzenepropanenitrile4640-67-9 8-Fluoro-4-hydroxyquinoline63010-71-9

Elsewhere

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