1-(4-chloropyridin-2-yl)-2,2,2-trifluoroethyl trifluoromethanesulfonate

1-(4-chloropyridin-2-yl)-2,2,2-trifluoroethyl trifluoromethanesulfonate

CAS: 1356087-54-1

Formula: C8H4ClF6NO3S

SMILES: FC(F)(F)C(OS(=O)(=O)C(F)(F)F)C1=NC=CC(Cl)=C1

IUPAC: 1-(4-chloropyridin-2-yl)-2,2,2-trifluoroethyl trifluoromethanesulfonate

InChI: InChI=1/C8H4ClF6NO3S/c9-4-1-2-16-5(3-4)6(7(10,11)12)19-20(17,18)8(13,14)15/h1-3,6H

Composition: C (27.96%), H (1.17%), Cl (10.32%), F (33.17%), N (4.08%), O (13.97%), S (9.33%)

Molar Mass: 343.62

Atom Count: 24

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	342.9504608
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	UIGLSIWKRYUOJI-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.4
Topological Polar Surface Area	56.26
Polarizability	21.47
Ring Count	1
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1356087-54-1		$107.19-$510.71$107.19$157.63$510.71