2-methanesulfonyl-3-(trifluoromethyl)pyridine

2-methanesulfonyl-3-(trifluoromethyl)pyridine

CAS: 886498-06-2

Formula: C7H6F3NO2S

SMILES: CS(=O)(=O)C1=NC=CC=C1C(F)(F)F

IUPAC: 2-methanesulfonyl-3-(trifluoromethyl)pyridine

InChI: InChI=1S/C7H6F3NO2S/c1-14(12,13)6-5(7(8,9)10)3-2-4-11-6/h2-4H,1H3

Composition: C (37.34%), H (2.69%), F (25.31%), N (6.22%), O (14.21%), S (14.24%)

Molar Mass: 225.19

Atom Count: 20

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	225.0071341
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	NEBOYTZGLSKYSC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.19
Topological Polar Surface Area	47.03
Polarizability	16.86
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	886498-06-2		$51.35-$225.06$51.35$63.37$86.31$225.06