Nickel(II) trifluoromethanesulfonate

C₂F₆NiO₆S₂CAS 60871-84-3356.82 g/mol

Open in Covalent MOL file

Alkyl halide Sulfonic acid

Properties

Molecular formula: C₂F₆NiO₆S₂
Molar mass: 356.82 g/mol
Exact mass: 355.8394 Da
logP: 0.10Crippen estimate
Polar surface area: 114.4 Å²
H-bond donors / acceptors: 0 / 6
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation95.1% of notifiers
H317 May cause an allergic skin reaction100% of notifiers
H319 Causes serious eye irritation95.1% of notifiers
H335 May cause respiratory irritation95.1% of notifiers
H351 Suspected of causing cancer92.7% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

60871-84-3

SMILES

C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Ni+2]

InChIKey

KVRSDIJOUNNFMZ-UHFFFAOYSA-L

InChI

InChI=1S/2CHF3O3S.Ni/c2*2-1(3,4)8(5,6)7;/h2*(H,5,6,7);/q;;+2/p-2

Weigh it out

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

Work with Nickel(II) trifluoromethanesulfonate

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.

Triflic acid1493-13-6Free acid Lithium triflate33454-82-9Salt Zinc triflate54010-75-2Salt Copper(II) triflate34946-82-2Salt Silver trifluoromethanesulfonate2923-28-6Salt Scandium(III) trifluoromethanesulfonate144026-79-9Salt N-Fluoropyridinium triflate107263-95-6Salt 1-Butyl-3-methylimidazolium trifluoromethanesulfonate174899-66-2Salt 1-Ethyl-3-methylimidazolium trifluoromethanesulfonate145022-44-2Salt Triphenylsulfonium triflate66003-78-9Salt Yttrium triflate52093-30-8Salt Diphenyliodonium triflate66003-76-7Salt

Similar compounds

Hafnium(IV) trifluoromethanesulfonate161337-67-371 % similar Bis(1,5-cyclooctadiene)rhodium(I) trifluoromethanesulfonate99326-34-856 % similar Trifluoromethanesulfonyl chloride421-83-038 % similar 1,1,1-Trifluoromethanesulfonamide421-85-238 % similar Nickel(II) sulfate7786-81-436 % similar Lithium nonafluorobutanesulfonate131651-65-534 % similar Potassium perfluorobutanesulfonate29420-49-334 % similar Potassium perfluorooctanesulfonate2795-39-333 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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