(2,4-Difluorophenyl)(piperidin-4-yl)methanone hydrochloride

C₁₂H₁₄ClF₂NOCAS 106266-04-0261.70 g/mol

Open in Covalent MOL file

Halogen Ketone Secondary Amine

Properties

Molecular formula: C₁₂H₁₄ClF₂NO
Molar mass: 261.70 g/mol
Exact mass: 261.0732 Da
logP: 2.57Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Identifiers

CAS number

106266-04-0

SMILES

Cl.O=C(c1ccc(F)cc1F)C1CCNCC1

InChIKey

QPJONRGTWKXJLG-UHFFFAOYSA-N

InChI

InChI=1S/C12H13F2NO.ClH/c13-9-1-2-10(11(14)7-9)12(16)8-3-5-15-6-4-8;/h1-2,7-8,15H,3-6H2;1H

Weigh it out

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

Names and synonyms

3 names

Methanone, (2,4-difluorophenyl)-4-piperidinyl-, hydrochloride (1:1)
Methanone, (2,4-difluorophenyl)-4-piperidinyl-, hydrochloride
4-(2,4-Difluorobenzoyl)piperidine hydrochloride

Work with (2,4-Difluorophenyl)(piperidin-4-yl)methanone 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

Elsewhere

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