Bis(pyridine)iodonium tetrafluoroborate

C₁₀H₁₂BF₄IN₂CAS 15656-28-7373.93 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₀H₁₂BF₄IN₂
Molar mass: 373.93 g/mol
Exact mass: 374.0074 Da
logP: -0.07Crippen estimate
Polar surface area: 25.8 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

Warning

H315 Causes skin irritation97.8% of notifiers
H319 Causes serious eye irritation97.8% of notifiers
H335 May cause respiratory irritation97.8% of notifiers

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

Precautionary statements

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

Identifiers

CAS number

15656-28-7

SMILES

[B-](F)(F)(F)F.C1=CC=NC=C1.C1=CC=NC=C1.[IH2+]

InChIKey

WVXJCTSZJWIBQT-UHFFFAOYSA-N

InChI

InChI=1S/2C5H5N.BF4.H2I/c2*1-2-4-6-5-3-1;2-1(3,4)5;/h2*1-5H;;1H2/q;;-1;+1

Weigh it out

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

Work with Bis(pyridine)iodonium tetrafluoroborate

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.

Pyridine110-86-1Free base Pyridine-D57291-22-7Free base, labelled Pyridinium chlorochromate26299-14-9Salt Pyridinium p-toluenesulfonate24057-28-1Salt Sulfur trioxide pyridine complex26412-87-3Salt Pyridinium chloride628-13-7Salt Poly(pyridine fluoride)62778-11-4Salt Pyridinium hydrobromide18820-82-1Salt Pyridinium trifluoroacetate464-05-1Salt Hydrofluoric acid pyridine complex32001-55-1Salt Pyridine methanesulfonate39879-60-2Salt Pyridinium fluorochromate83042-08-4Salt

Similar compounds

Cycloheptatrienylium tetrafluoroborate27081-10-338 % similar Silver tetrafluoroborate14104-20-235 % similar N-Fluoropyridinium tetrafluoroborate107264-09-535 % similar Tetrafluoroboric acid16872-11-033 % similar Cornforth reagent20039-37-633 % similar Triphenylcarbenium tetrafluoroborate341-02-633 % similar Nitrosonium tetrafluoroborate14635-75-730 % similar 1-Butylpyridinium tetrafluoroborate203389-28-030 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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