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1-[(4-ethoxyphenyl)methyl]piperazine

1-[(4-ethoxyphenyl)methyl]piperazine

CAS: 21867-70-9

Formula: C13H20N2O

SMILES: CCOC1=CC=C(CN2CCNCC2)C=C1

IUPAC: 1-[(4-ethoxyphenyl)methyl]piperazine

InChI: InChI=1S/C13H20N2O/c1-2-16-13-5-3-12(4-6-13)11-15-9-7-14-8-10-15/h3-6,14H,2,7-11H2,1H3

Composition: C (70.87%), H (9.15%), N (12.72%), O (7.26%)

Molar Mass: 220.316

Atom Count: 36

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 220.157563272
Formal Charge 0
FSP3 0.54
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey UBALQHBNQQCDGM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.57
Topological Polar Surface Area 24.5
Polarizability 26.23
Ring Count 2
Rotatable Bond Count 4

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