CAS 25519-78-2|4-(4-Fluorobenzoyl)piperidine hydrochloride|4-(4-fluorobenzoyl)piperidine hydrochloride|4-(4-fluorobenzoyl)piperidine hydrochloride|4-(p-Fluorobenzoyl)piperidine hydrochloride|p-Fluor...

General Information

Structure

Molecular Formula

C₁₂H₁₅ClFNO

Molecular Mass

243.7050032

Exact Mass

243.08262001

Charge

InChI

InChI=1S/C12H14FNO.ClH/c13-11-3-1-9(2-4-11)12(15)10-5-7-14-8-6-10;/h1-4,10,14H,5-8H2;1H

InChIKey

GPKDBZQZPNOBGM-UHFFFAOYSA-N

Canonic Smiles

O=C(c1ccc(cc1)F)C1CCNCC1.Cl

Isomeric Smiles

c1c(ccc(c1)C(=O)C1CCNCC1)F.Cl

Calculated Properties

JChem

Acid pKa

16.647728

H Acceptors

H Donor

LogD (pH = 5.5)

-1.4448847

LogD (pH = 7.4)

-0.79010445

Log P

1.7771732

Molar Refractivity

57.1088

Polarizability

21.88143

Polar Surface Area

29.1

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

4-(4-Fluorobenzoyl)piperidine hydrochloride4-(p-Fluorobenzoyl)piperidine hydrochloridep-Fluorophenyl 4-Piperidinyl Ketone Hydrochloride(4-Fluorophenyl)(piperidin-4-yl)methanone hydrochloride(4-fluorophenyl)-4-piperidinylmethanone Hydrochloridep-Fluorophenyl 4-piperidylketone Hydrochloride4-Fluorophenyl 4-piperidinyl Ketone Hydrochloride4-(4-Fluorobenzoyl)piperidine hydrochloride 97%4-(4-Fluorobenzoyl)piperidine hydrochloride4-4-氟苯甲酰哌啶盐酸盐

IUPAC name

4-(4-fluorobenzoyl)piperidine hydrochloride

IUPAC Traditional name

4-(4-fluorobenzoyl)piperidine hydrochloride

Names and Identifiers

Registration numbers

CAS Number

25519-78-2

MDL Number

MFCD00044912

EC Number

247-070-0