Tetrabutylammonium difluorotriphenylstannate

C₃₄H₅₁F₂NSnCAS 139353-88-1630.50 g/mol

Open in Covalent MOL file

Quaternary ammonium

Properties

Molecular formula: C₃₄H₅₁F₂NSn
Molar mass: 630.50 g/mol
Exact mass: 631.3012 Da
logP: 8.05Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 15

Hazards

Danger

H301 Toxic if swallowed88.9% of notifiers
H311 Toxic in contact with skin88.9% of notifiers
H331 Toxic if inhaled88.9% of notifiers
H400 Very toxic to aquatic life97.8% of notifiers
H410 Very toxic to aquatic life with long lasting effects97.8% of notifiers

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P262, P264, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P316, P321, P330, P361+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

139353-88-1

SMILES

CCCC[N+](CCCC)(CCCC)CCCC.C1=CC=C(C=C1)[Sn-](C2=CC=CC=C2)(C3=CC=CC=C3)(F)F

InChIKey

ODMXVCNGZGLSRS-UHFFFAOYSA-L

InChI

InChI=1S/C16H36N.3C6H5.2FH.Sn/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;3*1-2-4-6-5-3-1;;;/h5-16H2,1-4H3;3*1-5H;2*1H;/q+1;;;;;;+1/p-2

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Tetrabutylammonium difluorotriphenylstannate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Tetra-n-butylammonium iodide311-28-4Salt Tetra-n-butylammonium fluoride429-41-4Salt Tetrabutylammonium bromide1643-19-2Salt Tetrabutylammonium chloride1112-67-0Salt Tetrabutylammonium hexafluorophosphate3109-63-5Salt Tetrabutylammonium hydroxide2052-49-5Salt Tetrabutylammonium tribromide38932-80-8Salt Tetrabutylammonium tetrafluoroborate429-42-5Salt Tetrabutylammonium borohydride33725-74-5Salt Tetrabutylammonium hydrogen sulfate32503-27-8Salt Tetrabutylammonium perchlorate1923-70-2Salt Tetrabutylammonium acetate10534-59-5Salt

Similar compounds

Benzyltributylammonium chloride23616-79-750 % similar Benzyltributylammonium bromide25316-59-050 % similar n-Butylbenzene104-51-842 % similar Pentylbenzene538-68-141 % similar Butyl phenyl ether1126-79-040 % similar Decylbenzene104-72-339 % similar Hexylbenzene1077-16-339 % similar Heptylbenzene1078-71-339 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook