[1-[(4-methylphenyl)sulfonylmethyl]pyridin-4-yl]-phenyl-methanone; trifluoromethanesulfonic acid

Modify Date: 2025-09-23 18:31:33

[1-[(4-methylphenyl)sulfonylmethyl]pyridin-4-yl]-phenyl-methanone; trifluoromethanesulfonic acid structure	Common Name	[1-[(4-methylphenyl)sulfonylmethyl]pyridin-4-yl]-phenyl-methanone; trifluoromethanesulfonic acid
	CAS Number	58747-56-1	Molecular Weight	501.49600
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₂₁H₁₈F₃NO₆S₂	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	[1-[(4-methylphenyl)sulfonylmethyl]pyridin-1-ium-4-yl]-phenylmethanone,trifluoromethanesulfonate

Molecular Formula	C₂₁H₁₈F₃NO₆S₂
Molecular Weight	501.49600
Exact Mass	501.05300
PSA	129.05000
LogP	5.15790
InChIKey	CATGZAPHAJNXSB-UHFFFAOYSA-M
SMILES	Cc1ccc(S(=O)(=O)C[n+]2ccc(C(=O)c3ccccc3)cc2)cc1.O=S(=O)([O-])C(F)(F)F

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