5-Fluoroquinazolin-4-ol

C₈H₅FN₂OCAS 436-72-6164.14 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₅FN₂O
Molar mass: 164.14 g/mol
Exact mass: 164.0386 Da
logP: 1.06Crippen estimate
Polar surface area: 45.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

436-72-6

SMILES

C1=CC2=C(C(=C1)F)C(=O)NC=N2

InChIKey

UXEZULVIMJVIFB-UHFFFAOYSA-N

InChI

InChI=1S/C8H5FN2O/c9-5-2-1-3-6-7(5)8(12)11-4-10-6/h1-4H,(H,10,11,12)

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Names and synonyms

1 names

5-Fluoro-4-hydroxyquinazoline

Work with 5-Fluoroquinazolin-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

5-Fluoroquinazolin-4-amine137553-48-144 % similar 9-Deazahypoxanthine5655-01-643 % similar 3-Fluoro-2-hydroxypyridine1547-29-143 % similar 3H,4H-Thieno[3,2-d]pyrimidin-4-one16234-10-941 % similar 7-Fluoro-6-nitroquinazolin-4(1H)-one162012-69-340 % similar 7-Bromo-1H-quinazolin-4-one194851-16-638 % similar 6-Bromoquinazolin-4-ol32084-59-638 % similar 4-Hydroxypyrido (2,3-d)pyrimidine24410-19-338 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

7-Fluoroquinazolin-4(3H)-one16499-57-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook