8-(trifluoromethyl)quinoline-5-carbonitrile

8-(trifluoromethyl)quinoline-5-carbonitrile

Formula: C11H5F3N2

SMILES: FC(F)(F)C1=C2N=CC=CC2=C(C=C1)C#N

IUPAC: 8-(trifluoromethyl)quinoline-5-carbonitrile

InChI: InChI=1S/C11H5F3N2/c12-11(13,14)9-4-3-7(6-15)8-2-1-5-16-10(8)9/h1-5H

Composition: C (59.47%), H (2.27%), F (25.65%), N (12.61%)

Molar Mass: 222.17

Atom Count: 21

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	222.040482658
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	YMUNLVNYRLSQNH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.67
Topological Polar Surface Area	36.68
Polarizability	19.79
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C11H5F3N2		Quote Only