Ethyl 4,6-dichloropyridazine-3-carboxylate

C₇H₆Cl₂N₂O₂CAS 679406-03-2221.04 g/mol

Open in Covalent MOL file

Aryl halide Ester

Properties

Molecular formula: C₇H₆Cl₂N₂O₂
Molar mass: 221.04 g/mol
Exact mass: 219.9806 Da
logP: 1.96Crippen estimate
Polar surface area: 52.1 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 2

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

679406-03-2

SMILES

CCOC(=O)C1=NN=C(C=C1Cl)Cl

InChIKey

MOWPWJUYSRHMHS-UHFFFAOYSA-N

InChI

InChI=1S/C7H6Cl2N2O2/c1-2-13-7(12)6-4(8)3-5(9)10-11-6/h3H,2H2,1H3

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Work with Ethyl 4,6-dichloropyridazine-3-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

4,6-Dichloropyridazine-3-carboxylic acid methyl ester372118-01-966 % similar Ethyl 4,6-dichloropyridine-3-carboxylate40296-46-660 % similar 4,6-Dichloro-2-methyl-nicotinic acid ethyl ester686279-09-457 % similar Ethyl 6-chloro-3-pyridazinecarboxylate75680-92-156 % similar Ethyl 3-chloro-5-(trifluoromethyl)pyridine-2-carboxylate128073-16-553 % similar Ethyl o-chlorobenzoate7335-25-351 % similar 4,6-Dichloro-3-pyridazinecarboxylic acid1040246-87-450 % similar Ethyl 3,5-dichloro-4-hydroxybenzoate17302-82-849 % similar

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

Same formula

Ethyl 2,4-dichloro-5-pyrimidinecarboxylate51940-64-8

Elsewhere

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