2-Chloro-1,3-dimethylimidazolidium tetrafluoroborate

C₅H₁₀BClF₄N₂CAS 153433-26-2220.40 g/mol

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Properties

Molecular formula: C₅H₁₀BClF₄N₂
Molar mass: 220.40 g/mol
Exact mass: 220.0562 Da
Melting point: 140–150 °C
logP: 0.80Crippen estimate
Polar surface area: 6.5 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

153433-26-2

SMILES

CN1CCN(C)C1=[Cl+].F[B-](F)(F)F

InChIKey

UPLXKEIRISBKRM-UHFFFAOYSA-N

InChI

InChI=1S/C5H10ClN2.BF4/c1-7-3-4-8(2)5(7)6;2-1(3,4)5/h3-4H2,1-2H3;/q+1;-1

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Names and synonyms

4 names

1H-Imidazolium, 2-chloro-4,5-dihydro-1,3-dimethyl-, tetrafluoroborate(1-) (1:1)
1H-Imidazolium, 2-chloro-4,5-dihydro-1,3-dimethyl-, tetrafluoroborate(1-)
2-Chloro-1,3-dimethyl-4,5-dihydroimidazolium tetrafluoroborate
2-Chloro-1,3-dimethylimidazolidinium tetrafluoroborate

Work with 2-Chloro-1,3-dimethylimidazolidium 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

Similar compounds

1,3-Dimethyl-2-imidazolidinethione13461-16-033 % similar 1,3-Dimethyl-2-imidazolidinone80-73-933 % similar 1,3-Dimethyl-2-fluoroimidazolium hexafluorophosphate164298-27-531 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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