chempirical

1-(4-Nitrophenyl)piperazine

C10H13N3O2CAS 6269-89-2207.23 g/mol

Open in Covalent MOL file
ON+O−NNH
NitroSecondary AmineTertiary Amine

Properties

Molecular formula
C10H13N3O2
Molar mass
207.23 g/mol
Exact mass
207.1008 Da
Melting point
135 °C
logP
1.00Crippen estimate
Polar surface area
58.4 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
2

Identifiers

CAS number
6269-89-2
SMILES
O=[N+]([O-])c1ccc(N2CCNCC2)cc1
InChIKey
VWOJSRICSKDKAW-UHFFFAOYSA-N
InChI
InChI=1S/C10H13N3O2/c14-13(15)10-3-1-9(2-4-10)12-7-5-11-6-8-12/h1-4,11H,5-8H2

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Names and synonyms

9 names
  • Piperazine, 1-(4-nitrophenyl)-
  • Piperazine, 1-(p-nitrophenyl)-
  • 1-(p-Nitrophenyl)piperazine
  • N-(4-Nitrophenyl)piperazine
  • NSC 148473
  • NSC 33874
  • N-(p-Nitrophenyl)piperazine
  • 1-(4-Nitrophenyl)piperiazine
  • 4-(Piperazin-1-yl)-nitrobenzene

Work with 1-(4-Nitrophenyl)piperazine

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

Same formula

1-(2-Pyrimidinyl)-4-piperidinecarboxylic acid303144-44-7 1-(2-Nitrophenyl)piperazine59084-06-9 1,1-Dimethylethyl N-(2-cyano-1H-pyrrol-1-yl)carbamate937046-96-3

Elsewhere

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