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1-[(3-fluorophenyl)methyl]piperazine dihydrochloride

1-[(3-fluorophenyl)methyl]piperazine dihydrochloride

CAS: 199672-04-3

Formula: C11H17Cl2FN2

SMILES: Cl.Cl.FC1=CC=CC(CN2CCNCC2)=C1

IUPAC: 1-[(3-fluorophenyl)methyl]piperazine dihydrochloride

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

Composition: C (49.45%), H (6.41%), Cl (26.54%), F (7.11%), N (10.49%)

Molar Mass: 267.17

Atom Count: 33

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 266.0752821
Formal Charge 0
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey BRNBEBNBUUJUPC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.57
Topological Polar Surface Area 15.27
Polarizability 21.5
Ring Count 2
Rotatable Bond Count 2

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Kinentia Biosciences LLC
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Purity LeadTime CAS PacketSize UnitPrice
95% <14 Days 199672-04-3 $204.12$204.12
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Crea-Chim UAB
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95% <7 Days 199672-04-3 $39.00$39.00
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