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4-{[6-chloro-4-(trifluoromethyl)pyridin-2-yl]oxy}aniline

4-{[6-chloro-4-(trifluoromethyl)pyridin-2-yl]oxy}aniline

CAS: 86575-23-7

Formula: C12H8ClF3N2O

SMILES: NC1=CC=C(OC2=CC(=CC(Cl)=N2)C(F)(F)F)C=C1

IUPAC: 4-{[6-chloro-4-(trifluoromethyl)pyridin-2-yl]oxy}aniline

InChI: InChI=1S/C12H8ClF3N2O/c13-10-5-7(12(14,15)16)6-11(18-10)19-9-3-1-8(17)2-4-9/h1-6H,17H2

Composition: C (49.93%), H (2.79%), Cl (12.28%), F (19.75%), N (9.71%), O (5.54%)

Molar Mass: 288.65

Atom Count: 27

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 288.0277251
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey QGFYTVHRUSHVSZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 67
Topological Polar Surface Area 48.14
Polarizability 24.06
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 86575-23-7 $51.35-$86.31$51.35$63.37$86.31
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