Methyl 3,6-dichloropyridazine-4-carboxylate

C₆H₄Cl₂N₂O₂CAS 286946-24-5207.01 g/mol

Open in Covalent MOL file

Aryl halide Ester

Properties

Molecular formula: C₆H₄Cl₂N₂O₂
Molar mass: 207.01 g/mol
Exact mass: 205.9650 Da
logP: 1.57Crippen estimate
Polar surface area: 52.1 Å²
H-bond donors / acceptors: 0 / 4
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

286946-24-5

SMILES

COC(=O)C1=CC(=NN=C1Cl)Cl

InChIKey

LQNIJCUBJNDOHH-UHFFFAOYSA-N

InChI

InChI=1S/C6H4Cl2N2O2/c1-12-6(11)3-2-4(7)9-10-5(3)8/h2H,1H3

Weigh it out

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Work with Methyl 3,6-dichloropyridazine-4-carboxylate

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

3,6-Dichloropyridazine-4-carboxylic acid51149-08-754 % similar Methyl 6-chloropyridazine-4-carboxylate1093860-48-054 % similar Methyl 5-bromo-2-chloronicotinate78686-79-054 % similar Methyl2-chloro-5-fluoronicotinate847729-27-554 % similar Methyl 5-bromo-2-chloro-4-pyridinecarboxylate886365-28-254 % similar Methyl 6-chloropyridazine-3-carboxylate65202-50-853 % similar Methyl4,6-dichloronicotinate65973-52-653 % similar Methyl 2,6-dichloroisonicotinate42521-09-551 % similar

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

Same formula

Aminopyralid150114-71-9 2,4-Dichloro-6-nitroaniline2683-43-4 Methyl2,4-dichloropyrimidine-5-carboxylate3177-20-6 4,6-Dichloropyridazine-3-carboxylic acid methyl ester372118-01-9 2,6-Dichloro-3-methyl-5-nitropyridine58596-88-6 2,6-Dichloro-4-methyl-3-nitropyridine60010-03-9 2,4-Dichloro-6-methyl-3-nitropyridine63897-12-1 2,5-Dichloro-4-nitrobenzenamine6627-34-5

Elsewhere

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