1-(2-{[5-(trifluoromethyl)pyridin-2-yl]oxy}ethyl)piperazine

1-(2-{[5-(trifluoromethyl)pyridin-2-yl]oxy}ethyl)piperazine

CAS: 1000339-99-0

Formula: C12H16F3N3O

SMILES: FC(F)(F)C1=CN=C(OCCN2CCNCC2)C=C1

IUPAC: 1-(2-{[5-(trifluoromethyl)pyridin-2-yl]oxy}ethyl)piperazine

InChI: InChI=1S/C12H16F3N3O/c13-12(14,15)10-1-2-11(17-9-10)19-8-7-18-5-3-16-4-6-18/h1-2,9,16H,3-8H2

Composition: C (52.36%), H (5.86%), F (20.70%), N (15.27%), O (5.81%)

Molar Mass: 275.275

Atom Count: 35

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	275.124546636
Formal Charge	0
FSP3	0.58
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	ZVFRHRVMTKRPPX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.43
Topological Polar Surface Area	37.39
Polarizability	24.61
Ring Count	2
Rotatable Bond Count	5

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90%	<2 Days	1000339-99-0		$51.35-$86.31$51.35$63.37$86.31