α-Amino-p-chloroacetophenone hydrochloride

C₈H₉Cl₂NOCAS 5467-71-0206.07 g/mol

Open in Covalent MOL file

Aryl halide Ketone Primary amine

Properties

Molecular formula: C₈H₉Cl₂NO
Molar mass: 206.07 g/mol
Exact mass: 205.0061 Da
Melting point: 290 °C
logP: 1.90Crippen estimate
Polar surface area: 43.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Identifiers

CAS number

5467-71-0

SMILES

Cl.NCC(=O)c1ccc(Cl)cc1

InChIKey

OVKMQHKVUWBLSV-UHFFFAOYSA-N

InChI

InChI=1S/C8H8ClNO.ClH/c9-7-3-1-6(2-4-7)8(11)5-10;/h1-4H,5,10H2;1H

Weigh it out

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

Names and synonyms

9 names

Ethanone, 2-amino-1-(4-chlorophenyl)-, hydrochloride (1:1)
Acetophenone, 2-amino-4′-chloro-, hydrochloride
Ethanone, 2-amino-1-(4-chlorophenyl)-, hydrochloride
2-Amino-1-(4-chlorophenyl)-1-ethanone hydrochloride
α-Amino-4′-chloroacetophenone hydrochloride
2-Amino-1-(4-chlorophenyl)ethanone hydrochloride
2-Amino-4′-chloroacetophenone hydrochloride
α-Amino-4-chloroacetophenone hydrochloride
p-Chlorophenacylamine hydrochloride

Work with α-Amino-p-chloroacetophenone hydrochloride

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-Aminoacetophenone hydrochloride5468-37-167 % similar α-Amino-p-bromoacetophenone hydrochloride5467-72-164 % similar 2-Aminoacetophenone613-89-857 % similar 2,4′-Dichloroacetophenone937-20-256 % similar α-Amino-p-nitroacetophenone hydrochloride5425-81-055 % similar 2′-Bromo-4-chloroacetophenone536-38-955 % similar 1-(4-Chlorophenyl)-1-propanone6285-05-855 % similar 1-(4-Chlorophenyl)-2-phenylethanone1889-71-054 % similar

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

Same formula

D-(-)-2-Amino-2-phenylacetyl chloride hydrochloride39878-87-0

Elsewhere

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