Sodium 1,1-difluoro-4-(2-methyl-1,3-dioxolan-2-yl)butane-1-sulfinate

ALDRICH/792446

Synonym: Shabat Sulfinate

CAS Number: 1584701-12-1
Empirical Formula (Hill Notation): C₈H₁₃F₂NaO₄S
Molecular Weight: 266.24
MDL Number: MFCD28016342
Linear Formula: C₈H₁₃F₂NaO₄S
Product Type: Chemical

Catalog Number	PKG Qty.	Price


45-792446-100MG	100 mg	$279.00 1/EA	Add To Favorites

Baran Diversinate for Late-Stage Functionalization

Properties
Descriptions
Safety Info.
Basic Data

form	solid
InChI	1S/C8H14F2O4S.Na/c1-7(13-5-6-14-7)3-2-4-8(9,10)15(11)12;/h2-6H2,1H3,(H,11,12);/q;+1/p-1
InChI key	UDXMRVSKBPZBMK-UHFFFAOYSA-M
reaction suitability	reaction type: C-C Bond Formation
	reagent type: catalyst reaction type: C-H Activation
	reagent type: linker
SMILES string	[O-]S(C(F)(F)CCCC1(C)OCCO1)=O.[Na+]

Application:	Shabat sulfinate is a difluoroalkyl ketal sulfinate sodium salt that has been used as a reagent for the introduction of the ketone functional groups on heterocyclic bioactive molecules via derivatization of C-H bonds.
Other Notes:	Tagging the Untaggable: A Difluoroalkyl-Sulfinate Ketone-Based Reagent for Direct C-H Functionalization of Bioactive Heteroarenes
Packaging:	100 mg in amber glass bottle

Symbol	GHS07
Signal word	Warning
Hazard statements	H315 - H319 - H335
Precautionary statements	P302 + P352 - P305 + P351 + P338
Hazard Codes	Xi
Risk Statements	36/37/38
Safety Statements	26
RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	Not applicable
Flash Point(C)	Not applicable

UNSPSC

12352005

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