chempirical

4'-Amino-2'-hydroxyacetophenone

C8H9NO2CAS 2476-29-1151.16 g/mol

Open in Covalent MOL file
ONH2HO
KetonePhenolPrimary amine

Properties

Molecular formula
C8H9NO2
Molar mass
151.16 g/mol
Exact mass
151.0633 Da
logP
1.18Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Identifiers

CAS number
2476-29-1
SMILES
CC(=O)C1=C(C=C(C=C1)N)O
InChIKey
QQZFVONVJPXCSQ-UHFFFAOYSA-N
InChI
InChI=1S/C8H9NO2/c1-5(10)7-3-2-6(9)4-8(7)11/h2-4,11H,9H2,1H3

Weigh it out

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

Work with 4'-Amino-2'-hydroxyacetophenone

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

2′-Hydroxy-4′-methylacetophenone6921-64-867 % similar 2′,4′-Dihydroxyacetophenone89-84-964 % similar 4-Aminosalicylic acid65-49-662 % similar 1-(4-Fluoro-2-hydroxyphenyl)ethanone1481-27-260 % similar 1-(4-Bromo-2-hydroxyphenyl)ethan-1-one30186-18-660 % similar 1-(4-Chloro-2-hydroxyphenyl)ethanone6921-66-060 % similar Methyl 4-amino-2-hydroxybenzoate4136-97-459 % similar 4,6-Diacetylresorcinol2161-85-558 % similar

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

Same formula

1-Ethyl-4-nitrobenzene100-12-9 N-Phenylglycine103-01-5 Acetaminophen103-90-2 4-(Methylamino)benzoic acid10541-83-0 N-Methylanthranilic acid119-68-6 4-Aminophenylacetic acid1197-55-3 2,6-Dimethyl-4-nitrosophenol13331-93-6 Methyl anthranilate134-20-3

Elsewhere

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