3-Methyl-4-pyridinecarboxaldehyde

C₇H₇NOCAS 74663-96-0121.14 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₇NO
Molar mass: 121.14 g/mol
Exact mass: 121.0528 Da
logP: 1.20Crippen estimate
Polar surface area: 30.0 Å²
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

74663-96-0

SMILES

CC1=C(C=CN=C1)C=O

InChIKey

JFFOBFAGCSLMSV-UHFFFAOYSA-N

InChI

InChI=1S/C7H7NO/c1-6-4-8-3-2-7(6)5-9/h2-5H,1H3

Weigh it out

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

Work with 3-Methyl-4-pyridinecarboxaldehyde

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

3-Hydroxyisonicotinaldehyde1849-54-355 % similar 3-Fluoroisonicotinaldehyde40273-47-055 % similar 3-Amino-pyridine-4-carbaldehyde55279-29-355 % similar 3-Bromo-4-formylpyridine70201-43-355 % similar 3-Chloro-4-pyridinecarboxaldehyde72990-37-555 % similar 3,4-Dimethylpyridine583-58-452 % similar 2-Methylbenzaldehyde529-20-452 % similar 4-Chloropyridine-3-carboxaldehyde114077-82-650 % 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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