1-[(2,4-difluorophenyl)methyl]piperazine dihydrochloride

1-[(2,4-difluorophenyl)methyl]piperazine dihydrochloride

CAS: 870841-98-8

Formula: C11H16Cl2F2N2

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

IUPAC: 1-[(2,4-difluorophenyl)methyl]piperazine dihydrochloride

InChI: InChI=1S/C11H14F2N2.2ClH/c12-10-2-1-9(11(13)7-10)8-15-5-3-14-4-6-15;;/h1-2,7,14H,3-6,8H2;2*1H

Composition: C (46.33%), H (5.66%), Cl (24.86%), F (13.32%), N (9.82%)

Molar Mass: 285.16

Atom Count: 33

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	284.0658602
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	VLXWMIIZTMVINP-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.79
Topological Polar Surface Area	15.27
Polarizability	21.2
Ring Count	2
Rotatable Bond Count	2

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