1-(2-Nitrophenyl)piperazine

C₁₀H₁₃N₃O₂CAS 59084-06-9207.23 g/mol

Open in Covalent MOL file

Nitro Secondary Amine Tertiary Amine

Properties

Molecular formula: C₁₀H₁₃N₃O₂
Molar mass: 207.23 g/mol
Exact mass: 207.1008 Da
Boiling point: 120–126 °C (at 0.1 Torr)
logP: 1.00Crippen estimate
Polar surface area: 58.4 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 2

Identifiers

CAS number

59084-06-9

SMILES

O=[N+]([O-])c1ccccc1N1CCNCC1

InChIKey

YJRCDSXLKPERNV-UHFFFAOYSA-N

InChI

InChI=1S/C10H13N3O2/c14-13(15)10-4-2-1-3-9(10)12-7-5-11-6-8-12/h1-4,11H,5-8H2

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Names and synonyms

3 names

Piperazine, 1-(2-nitrophenyl)-
Piperazine, 1-(o-nitrophenyl)-
N-(2-Nitrophenyl)piperazine

Work with 1-(2-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-(4-Nitrophenyl)piperazine6269-89-2 1,1-Dimethylethyl N-(2-cyano-1H-pyrrol-1-yl)carbamate937046-96-3

Elsewhere

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