3-Methyl-1H-pyrazole-4-carbaldehyde

C₅H₆N₂OCAS 112758-40-4110.12 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₆N₂O
Molar mass: 110.12 g/mol
Exact mass: 110.0480 Da
logP: 0.53Crippen estimate
Polar surface area: 45.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

112758-40-4

SMILES

CC1=C(C=NN1)C=O

InChIKey

NWDMGTFNIOCVDU-UHFFFAOYSA-N

InChI

InChI=1S/C5H6N2O/c1-4-5(3-8)2-6-7-4/h2-3H,1H3,(H,6,7)

Weigh it out

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

Work with 3-Methyl-1H-pyrazole-4-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

Same formula

6-Methyl-3(2H)-pyridazinone13327-27-0 3-Hydroxypentanedinitrile13880-89-2 2-Amino-3-hydroxypyridine16867-03-1 3-Methoxypyridazine19064-65-4 3-Methyl-2(1H)-pyrazinone19838-07-4 4-Methoxypyridazine20733-11-3 1-(1H-Imidazol-1-yl)ethanone2466-76-4 1-Methyl-1H-pyrazole-4-carboxaldehyde25016-11-9

Elsewhere

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