4-(4-Fluorophenyl)piperidine

C₁₁H₁₄FNCAS 37656-48-7179.24 g/mol

Open in Covalent MOL file

Aryl halide Secondary amine

Properties

Molecular formula: C₁₁H₁₄FN
Molar mass: 179.24 g/mol
Exact mass: 179.1110 Da
logP: 2.29Crippen estimate
Polar surface area: 12.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin25% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage25% of notifiers
H319 Causes serious eye irritation75% of notifiers
H332 Harmful if inhaled25% of notifiers
H335 May cause respiratory irritation75% of notifiers

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

37656-48-7

SMILES

C1CNCCC1C2=CC=C(C=C2)F

InChIKey

AFYALJSDFPSAAZ-UHFFFAOYSA-N

InChI

InChI=1S/C11H14FN/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10/h1-4,10,13H,5-8H2

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Names and synonyms

1 names

4-(4-Fluoro-phenyl)-piperidine

Work with 4-(4-Fluorophenyl)piperidine

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

4-Phenylpiperidine771-99-359 % similar 4-(4-Bromophenyl)piperidine80980-89-859 % similar 1,2,3,4,5,6-Hexahydro-[4,4′]bipyridinyl581-45-355 % similar N-(4-Fluorophenyl)-4-piperidinamine38043-08-255 % similar 4-(4-Fluoro-benzyl)-piperidine92822-02-155 % similar 4-Phenylpiperidine hydrochloride10272-49-853 % similar 1-[Bis(4-fluorophenyl)methyl]piperazine27469-60-953 % similar (R)-2-(4-Fluorophenyl)pyrrolidine298690-89-850 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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