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4-[2-(pyridin-2-yl)ethyl]aniline dihydrochloride

4-[2-(pyridin-2-yl)ethyl]aniline dihydrochloride

CAS: 6318-71-4

Formula: C13H16Cl2N2

SMILES: Cl.Cl.NC1=CC=C(CCC2=NC=CC=C2)C=C1

IUPAC: 4-[2-(pyridin-2-yl)ethyl]aniline dihydrochloride

InChI: InChI=1S/C13H14N2.2ClH/c14-12-7-4-11(5-8-12)6-9-13-3-1-2-10-15-13;;/h1-5,7-8,10H,6,9,14H2;2*1H

Composition: C (57.58%), H (5.95%), Cl (26.14%), N (10.33%)

Molar Mass: 271.19

Atom Count: 33

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 270.0690539
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey YQRYXYMLGKVBDK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.52
Topological Polar Surface Area 38.91
Polarizability 23.73
Ring Count 2
Rotatable Bond Count 3

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