1-(2,3-Dichlorophenyl)piperazine hydrochloride

C10H13Cl3N2CAS 119532-26-2267.58 g/mol

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HClClNNHCl
Aryl halideSecondary amineTertiary amine

Properties

Molecular formula
C10H13Cl3N2
Molar mass
267.58 g/mol
Exact mass
266.0144 Da
logP
2.82Crippen estimate
Polar surface area
15.3 Ų
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.

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Identifiers

CAS number
119532-26-2
SMILES
Cl.Clc1cccc(N2CCNCC2)c1Cl
InChIKey
CYQFNNSFAGXCEC-UHFFFAOYSA-N
InChI
InChI=1S/C10H12Cl2N2.ClH/c11-8-2-1-3-9(10(8)12)14-6-4-13-5-7-14;/h1-3,13H,4-7H2;1H

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Names and synonyms

4 names
  • Piperazine, 1-(2,3-dichlorophenyl)-, hydrochloride (1:1)
  • Piperazine, 1-(2,3-dichlorophenyl)-, hydrochloride
  • Piperazine, 1-(2,3-dichlorophenyl)-, monohydrochloride
  • 1-(2,3-Dichlorophenyl)piperazine monohydrochloride

Work with 1-(2,3-Dichlorophenyl)piperazine 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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

2,3-Dichlorophenylpiperazine41202-77-1Free base

Similar compounds

N-(2-Chlorophenyl)piperazine monohydrochloride41202-32-876 % similar 1-(2-Chlorophenyl)piperazine39512-50-067 % similar Piperazine, 1-(3,4-dichlorophenyl)-, hydrochloride (1:2)76835-17-157 % similar 1-(2-Fluorophenyl)piperazine hydrochloride1011-16-153 % similar 1-(3-Chlorophenyl)piperazine hydrochloride13078-15-453 % similar 1-(3-Chlorophenyl)piperazine dihydrochloride51639-49-753 % similar 1-(3-Chlorophenyl)piperazine monohydrochloride65369-76-853 % similar N-(2-Methylphenyl)piperazine hydrochloride70849-60-453 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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