4-Fluoro-3-amino-acetophenone

C₈H₈FNOCAS 2002-82-6153.16 g/mol

Open in Covalent MOL file

Aryl halide Ketone Primary amine

Properties

Molecular formula: C₈H₈FNO
Molar mass: 153.16 g/mol
Exact mass: 153.0590 Da
logP: 1.61Crippen estimate
Polar surface area: 43.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

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

2002-82-6

SMILES

CC(=O)C1=CC(=C(C=C1)F)N

InChIKey

LUKSDHOQKVTGGT-UHFFFAOYSA-N

InChI

InChI=1S/C8H8FNO/c1-5(11)6-2-3-7(9)8(10)4-6/h2-4H,10H2,1H3

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Names and synonyms

1 names

3'-Amino-4'-fluoroacetophenone

Work with 4-Fluoro-3-amino-acetophenone

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

1-(3,4-Difluorophenyl)ethanone369-33-568 % similar 4-Fluoro-3-methylacetophenone369-32-462 % similar 1-(4-Fluoro-3-methoxyphenyl)ethanone64287-19-061 % similar 1-(3-Bromo-4-fluorophenyl)ethanone1007-15-460 % similar 3-Amino-4-fluorobenzoic acid2365-85-760 % similar 3'-Chloro-4'-fluoroacetophenone2923-66-260 % similar 3-Amino-4-fluorobenzoic acid methyl ester369-26-659 % similar 4'-Fluoro-3'-(trifluoromethyl)acetophenone208173-24-457 % similar

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

Same formula

5-Fluoro-2-methylbenzamide175278-28-1 2-Amino-5-fluoroacetophenone2343-25-1 N-(3-Fluorophenyl)acetamide351-28-0 N-(4-Fluorophenyl)acetamide351-83-7 2-Amino-4'-fluoroacetophenone369-43-7 2′-Fluoroacetanilide399-31-5 4-Fluoro-N-methylbenzamide701-49-5

Elsewhere

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