6-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile

6-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile

CAS: 338793-43-4

Formula: C13H5ClF3N5

SMILES: FC(F)(F)C1=CC(Cl)=C(N=C1)C1=CN2N=CC(C#N)=C2N=C1

IUPAC: 6-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile

InChI: InChI=1S/C13H5ClF3N5/c14-10-1-9(13(15,16)17)5-19-11(10)8-3-20-12-7(2-18)4-21-22(12)6-8/h1,3-6H

Composition: C (48.24%), H (1.56%), Cl (10.95%), F (17.61%), N (21.64%)

Molar Mass: 323.66

Atom Count: 27

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	323.0185574
Formal Charge	0
FSP3	0.08
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	SFHZNXLQPHCDGF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.88
Topological Polar Surface Area	66.87
Polarizability	27.36
Ring Count	3
Rotatable Bond Count	2

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	338793-43-4		$51.35-$524.40$51.35$63.37$86.31$524.40