Tetrabutylammonium difluorotriphenylstannate - CAS 139353-88-1

Name: Tetrabutylammonium difluorotriphenylstannate
Brand: BOC Sciences
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Catalog:	BB008926
Product Name:	Tetrabutylammonium difluorotriphenylstannate
CAS:	139353-88-1
Synonyms:	difluoro(triphenyl)stannanuide;tetrabutylazanium

Technical Data

IUPAC Name:	difluoro(triphenyl)stannanuide;tetrabutylazanium
Description:	Tetrabutylammonium difluorotriphenylstannate (CAS# 139353-88-1) is an organometallic reagent used in the preparation of disilene fluoride adducts. Tetrabutylammonium difluorotriphenylstannate has inorganic applications as well, used as a source of carbon or fluorine ligands via hypercoordination.
Molecular Weight:	630.48
Molecular Formula:	C34H51F2NSn
Canonical SMILES:	CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)[Sn-](C2=CC=CC=C2)(C3=CC=CC=C3)(F)F
InChI:	InChI=1S/C16H36N.3C6H5.2FH.Sn/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;31-2-4-6-5-3-1;;;/h5-16H2,1-4H3;31-5H;2*1H;/q+1;;;;;;+1/p-2
InChI Key:	ODMXVCNGZGLSRS-UHFFFAOYSA-L
Melting Point:	192-193 °C (lit.)
Purity:	> 97.0 % (T)
Appearance:	White crystalline powder
MDL:	MFCD00192465
LogP:	8.04680

GHS Hazard Statement:	H301 (88.64%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P391, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
US-2021238142-A1	Triflazoles and methods of making the same	20200131
WO-2021154345-A1	Triflazoles and methods of making the same	20200131
US-2021155652-A1	Tlr7 agonists	20191126
WO-2021105742-A1	An improved process for the preparation of pregabalin	20191126
WO-2021108649-A1	Tlr7 agonists	20191126

Complexity:	401
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	631.301160
Formal Charge:	0
Heavy Atom Count:	38
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	631.301160
Rotatable Bond Count:	15
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0