Ethyl 4,6-dichloropyridazine-3-carboxylate

C7H6Cl2N2O2CAS 679406-03-2221.04 g/mol

Open in Covalent MOL file
OONNClCl
Aryl halideEster

Properties

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

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

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

Weigh it out

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

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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