1-(2-Fluorobenzyl)piperazine

C₁₁H₁₅FN₂CAS 89292-78-4194.25 g/mol

Open in Covalent MOL file

Aryl halide Secondary amine Tertiary amine

Properties

Molecular formula: C₁₁H₁₅FN₂
Molar mass: 194.25 g/mol
Exact mass: 194.1219 Da
logP: 1.23Crippen estimate
Polar surface area: 15.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Warning

H319 Causes serious eye irritation97.5% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P351+P338, P337+P317

Identifiers

CAS number

89292-78-4

SMILES

C1CN(CCN1)CC2=CC=CC=C2F

InChIKey

IGVNZJBYRPULAI-UHFFFAOYSA-N

InChI

InChI=1S/C11H15FN2/c12-11-4-2-1-3-10(11)9-14-7-5-13-6-8-14/h1-4,13H,5-9H2

Weigh it out

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

Work with 1-(2-Fluorobenzyl)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

Similar compounds

1-((2-Chlorophenyl)methyl)piperazine17532-19-359 % similar 1-(1-Naphthylmethyl)piperazine40675-81-857 % similar 1-((2-Chloro-6-fluorophenyl)methyl)piperazine215655-20-257 % similar 1-Benzylpiperazine2759-17-353 % similar 1-Benzylpiperazine2759-28-653 % similar 1-(2-Fluorophenyl)piperazine1011-15-053 % similar 1-(2-Fluorophenyl)piperazine hydrochloride1011-16-149 % similar 4-Benzylpiperazine hydrochloride110475-31-549 % similar

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

Same formula

N-(4-Fluorophenyl)-4-piperidinamine38043-08-2 1-(3-Fluorobenzyl)piperazine55513-19-4 1-(4-Fluorobenzyl)piperazine70931-28-1

Elsewhere

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