chempirical

1-(3-Chlorophenyl)piperazine hydrochloride

C10H14Cl2N2CAS 13078-15-4233.14 g/mol

Open in Covalent MOL file
HClClNNH
Aryl halideSecondary amineTertiary amine

Properties

Molecular formula
C10H14Cl2N2
Molar mass
233.14 g/mol
Exact mass
232.0534 Da
logP
2.17Crippen estimate
Polar surface area
15.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
13078-15-4
SMILES
Cl.Clc1cccc(N2CCNCC2)c1
InChIKey
MHXPYWFZULXYHT-UHFFFAOYSA-N
InChI
InChI=1S/C10H13ClN2.ClH/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13;/h1-3,8,12H,4-7H2;1H

Weigh it out

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

Names and synonyms

6 names
  • Piperazine, 1-(3-chlorophenyl)-, hydrochloride (1:1)
  • Piperazine, 1-(m-chlorophenyl)-, monohydrochloride
  • Piperazine, 1-(3-chlorophenyl)-, monohydrochloride
  • 1-(m-Chlorophenyl)piperazine hydrochloride
  • m-CPP hydrochloride
  • N-(3-Chlorophenyl)piperazine hydrochloride

Work with 1-(3-Chlorophenyl)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

Similar compounds

1-(3-Chlorophenyl)piperazine dihydrochloride51639-49-7100 % similar 1-(3-Chlorophenyl)piperazine6640-24-089 % similar 1-(3-Methylphenyl)piperazine dihydrochloride13078-13-266 % similar N-(4-Chlorophenyl)piperazine dihydrochloride38869-46-466 % similar 1-Phenylpiperazine hydrochloride2210-93-765 % similar 1-(3,5-Dichlorophenyl)piperazine55827-50-461 % similar 1-(3-Trifluoromethylphenyl)piperazine hydrochloride16015-69-361 % similar 1-(3-Methoxyphenyl)piperazine dihydrochloride6968-76-961 % similar

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

Same formula

1-(4-Chlorophenyl)piperazine hydrochloride13078-12-1 N-(2-Chlorophenyl)piperazine monohydrochloride41202-32-8 Piperazine, 1-(3-chlorophenyl)-, hydrochloride (1:?)65369-76-8

Elsewhere

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