2-chloro-3-[3-(trifluoromethyl)phenyl]quinolin-5-ol

2-chloro-3-[3-(trifluoromethyl)phenyl]quinolin-5-ol

CAS: 1263386-30-6

Formula: C16H9ClF3NO

SMILES: OC1=C2C=C(C(Cl)=NC2=CC=C1)C1=CC(=CC=C1)C(F)(F)F

IUPAC: 2-chloro-3-[3-(trifluoromethyl)phenyl]quinolin-5-ol

InChI: InChI=1S/C16H9ClF3NO/c17-15-11(8-12-13(21-15)5-2-6-14(12)22)9-3-1-4-10(7-9)16(18,19)20/h1-8,22H

Composition: C (59.37%), H (2.80%), Cl (10.95%), F (17.61%), N (4.33%), O (4.94%)

Molar Mass: 323.7

Atom Count: 31

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	323.0324761
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	KWMQCTFJIYQIMF-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	78.94
Topological Polar Surface Area	33.12
Polarizability	31.36
Ring Count	3
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	1263386-30-6		$51.35-$86.31$51.35$63.37$86.31