chempirical

2-Methylisonicotinaldehyde

C7H7NOCAS 63875-01-4121.14 g/mol

Open in Covalent MOL file
NO
Aldehyde

Properties

Molecular formula
C7H7NO
Molar mass
121.14 g/mol
Exact mass
121.0528 Da
logP
1.20Crippen estimate
Polar surface area
30.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
63875-01-4
SMILES
CC1=NC=CC(=C1)C=O
InChIKey
SUMAWDZJEIQACJ-UHFFFAOYSA-N
InChI
InChI=1S/C7H7NO/c1-6-4-7(5-9)2-3-8-6/h2-5H,1H3

Weigh it out

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Names and synonyms

1 names
  • 2-Methylpyridine-4-carbaldehyde

Work with 2-Methylisonicotinaldehyde

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

4′-Methyl[2,2′-bipyridine]-4-carboxaldehyde104704-09-858 % similar 2-Chloro-4-pyridinecarboxaldehyde101066-61-955 % similar 2-Bromo-4-pyridinecarboxaldehyde118289-17-155 % similar 2-Methoxypyridine-4-carbaldehyde72716-87-155 % similar 4-Formyl-2-pyridinecarbonitrile131747-70-150 % similar 2,4-Lutidine108-47-448 % similar 2-Methylquinoline-6-carboxaldehyde108166-03-647 % similar Quinoxaline-6-carbaldehyde130345-50-547 % similar

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

Same formula

Formanilide103-70-8 4-Acetylpyridine1122-54-9 2-Acetylpyridine1122-62-9 6-Methyl-2-pyridinecarboxaldehyde1122-72-1 3-Acetylpyridine350-03-8 4-Methylnicotinaldehyde51227-28-2 2-Aminobenzaldehyde529-23-7 6-Methyl-3-pyridinecarboxaldehyde53014-84-9

Elsewhere

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