3-chloro-2-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridine

3-chloro-2-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridine

CAS: 246022-25-3

Formula: C9H5ClF3N3

SMILES: FC(F)(F)C1=CC(Cl)=C(N=C1)C1=CNN=C1

IUPAC: 3-chloro-2-(1H-pyrazol-4-yl)-5-(trifluoromethyl)pyridine

InChI: InChI=1S/C9H5ClF3N3/c10-7-1-6(9(11,12)13)4-14-8(7)5-2-15-16-3-5/h1-4H,(H,15,16)

Composition: C (43.66%), H (2.04%), Cl (14.32%), F (23.02%), N (16.97%)

Molar Mass: 247.61

Atom Count: 21

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	247.0124094
Formal Charge	0
FSP3	0.11
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NMPKIAAHGUXTDX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.13
Topological Polar Surface Area	41.57
Polarizability	20.28
Ring Count	2
Rotatable Bond Count	2

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95%	<2 Days	246022-25-3		$51.35-$524.40$51.35$63.37$86.31$524.40