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2-(4-methylphenyl)piperazine dihydrochloride

2-(4-methylphenyl)piperazine dihydrochloride

CAS: 65709-32-2

Formula: C11H18Cl2N2

SMILES: Cl.Cl.CC1=CC=C(C=C1)C1CNCCN1

IUPAC: 2-(4-methylphenyl)piperazine dihydrochloride

InChI: InChI=1/C11H16N2.2ClH/c1-9-2-4-10(5-3-9)11-8-12-6-7-13-11;;/h2-5,11-13H,6-8H2,1H3;2*1H

Composition: C (53.02%), H (7.28%), Cl (28.45%), N (11.24%)

Molar Mass: 249.18

Atom Count: 33

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 248.084704
Formal Charge 0
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey HHRIJMVJTZDXBM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.77
Topological Polar Surface Area 24.06
Polarizability 21.82
Ring Count 2
Rotatable Bond Count 1

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