1-Ethylquinolinium iodide

C₁₁H₁₂INCAS 634-35-5285.13 g/mol

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Properties

Molecular formula: C₁₁H₁₂IN
Molar mass: 285.13 g/mol
Exact mass: 285.0014 Da
Melting point: 156 °C
logP: -0.85Crippen estimate
Polar surface area: 3.9 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

Identifiers

CAS number

634-35-5

SMILES

CC[n+]1cccc2ccccc21.[I-]

InChIKey

PMYUGMDDIBOXQM-UHFFFAOYSA-M

InChI

InChI=1S/C11H12N.HI/c1-2-12-9-5-7-10-6-3-4-8-11(10)12;/h3-9H,2H2,1H3;1H/q+1;/p-1

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Names and synonyms

4 names

Quinolinium, 1-ethyl-, iodide (1:1)
Quinolinium, 1-ethyl-, iodide
N-Ethylquinolinium iodide
Quinoline ethiodide

Work with 1-Ethylquinolinium iodide

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-Ethyl-2-methylquinolinium iodide606-55-353 % similar 3-Ethyl-2-methylbenzothiazolium iodide3119-93-540 % similar Quinoline N-oxide1613-37-239 % similar Quinaldine red117-92-039 % similar 2-Bromo-1-ethylpyridinium tetrafluoroborate878-23-938 % similar 1-Ethyl-4-[3-(1-ethyl-4(1H)-quinolylidene)propenyl]quinolinium iodide4727-50-833 % similar Pinacyanol605-91-432 % similar Ethyltriphenylphosphonium iodide4736-60-131 % similar

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

Elsewhere

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