Quinoxaline-6-carbaldehyde

C₉H₆N₂OCAS 130345-50-5158.16 g/mol

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Properties

Molecular formula: C₉H₆N₂O
Molar mass: 158.16 g/mol
Exact mass: 158.0480 Da
logP: 1.44Crippen estimate
Polar surface area: 42.9 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

130345-50-5

SMILES

C1=CC2=NC=CN=C2C=C1C=O

InChIKey

UGOIXUFOAODGNI-UHFFFAOYSA-N

InChI

InChI=1S/C9H6N2O/c12-6-7-1-2-8-9(5-7)11-4-3-10-8/h1-6H

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Names and synonyms

1 names

Quinoxaline-6-carboxaldehyde

Work with Quinoxaline-6-carbaldehyde

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

1H-Benzimidazole-6-carboxaldehyde58442-17-452 % similar 2-Chloro-4-pyridinecarboxaldehyde101066-61-947 % similar 2-Bromo-4-pyridinecarboxaldehyde118289-17-147 % similar Protocatechuic aldehyde139-85-547 % similar 2-Methylquinoline-6-carboxaldehyde108166-03-644 % similar 4-Formyl-2-pyridinecarbonitrile131747-70-143 % similar Pyridine-4-carbaldehyde872-85-543 % similar 4-Carboxaldehydebenzocyclobutene112892-88-342 % similar

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

Elsewhere

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