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3-(pyridin-2-ylmethoxy)aniline

3-(pyridin-2-ylmethoxy)aniline

CAS: 105326-56-5

Formula: C12H12N2O

SMILES: NC1=CC=CC(OCC2=CC=CC=N2)=C1

IUPAC: 3-[(pyridin-2-yl)methoxy]aniline

InChI: InChI=1S/C12H12N2O/c13-10-4-3-6-12(8-10)15-9-11-5-1-2-7-14-11/h1-8H,9,13H2

Composition: C (71.98%), H (6.04%), N (13.99%), O (7.99%)

Molar Mass: 200.241

Atom Count: 27

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 200.094963014
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey HGHLFKVWEXFLES-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.16
Topological Polar Surface Area 48.14
Polarizability 22.68
Ring Count 2
Rotatable Bond Count 3

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