6-Oxo-1,4,5,6-tetrahydropyridazin-3-carboxylic acid

C₅H₆N₂O₃CAS 27372-38-9142.11 g/mol

Open in Covalent MOL file

Amide Carboxylic acid Hydrazone Lactam

Properties

Molecular formula: C₅H₆N₂O₃
Molar mass: 142.11 g/mol
Exact mass: 142.0378 Da
logP: -0.66Crippen estimate
Polar surface area: 78.8 Å²
H-bond donors / acceptors: 2 / 3
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

27372-38-9

SMILES

C1CC(=O)NN=C1C(=O)O

InChIKey

VUADWGRLHPTYPI-UHFFFAOYSA-N

InChI

InChI=1S/C5H6N2O3/c8-4-2-1-3(5(9)10)6-7-4/h1-2H2,(H,7,8)(H,9,10)

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Names and synonyms

1 names

1,4,5,6-Tetrahydro-6-oxo-3-pyridazinecarboxylic acid

Work with 6-Oxo-1,4,5,6-tetrahydropyridazin-3-carboxylic acid

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-tert-Butyl-4,5-dihydro-1H-pyrazol-5-one29211-68-534 % similar 3-Propyl-1,4-dihydropyrazol-5-one29211-70-933 % similar Oxalic acid144-62-732 % similar

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

Same formula

3,5-Dimethyl-4-nitroisoxazole1123-49-5 1-Methyl-2,4,6(1H,3H,5H)-pyrimidinetrione2565-47-1 Ethyl cyanohydroxyiminoacetate3849-21-6 5-(Hydroxymethyl)uracil4433-40-3 4,6-Dihydroxy-5-methoxypyrimidine5193-84-0 5-Methoxyuracil6623-81-0

Elsewhere

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