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1-[(2-methylphenyl)methyl]piperazine dihydrochloride

1-[(2-methylphenyl)methyl]piperazine dihydrochloride

CAS: 5321-51-7

Formula: C12H20Cl2N2

SMILES: Cl.Cl.CC1=C(CN2CCNCC2)C=CC=C1

IUPAC: 1-[(2-methylphenyl)methyl]piperazine dihydrochloride

InChI: InChI=1S/C12H18N2.2ClH/c1-11-4-2-3-5-12(11)10-14-8-6-13-7-9-14;;/h2-5,13H,6-10H2,1H3;2*1H

Composition: C (54.76%), H (7.66%), Cl (26.94%), N (10.64%)

Molar Mass: 263.21

Atom Count: 36

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 262.1003541
Formal Charge 0
FSP3 0.5
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey HVNSMSIMMNLDCH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.4
Topological Polar Surface Area 15.27
Polarizability 23.67
Ring Count 2
Rotatable Bond Count 2

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95% <4 Days 5321-51-7 $28.75-$1,189.10$28.75$116.15$234.60$1,189.10
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