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1402672-42-7

1402672-42-7 Structure

1402672-42-7 Structure
IdentificationBack Directory
[Name]

Pyrido[3,4-c]pyridazine-7(6H)-carboxylic acid, 3-chloro-5,8-dihydro-, 1,1-dimethylethyl ester
[CAS]

1402672-42-7
[Synonyms]

tert-butyl 1-chloro-7,8-dihydropyrido[3,4-d]pyridazine-6(5H)-carboxylate
Tert-butyl 3-chloro-6,8-dihydro-5H-pyrido[3,4-c]pyridazine-7-carboxylate
Pyrido[3,4-c]pyridazine-7(6H)-carboxylic acid, 3-chloro-5,8-dihydro-, 1,1-dimethylethyl ester
[Molecular Formula]

C12H16ClN3O2
[MOL File]

1402672-42-7.mol
[Molecular Weight]

269.73
Chemical PropertiesBack Directory
[Boiling point ]

425.8±45.0 °C(Predicted)
[density ]

1.266±0.06 g/cm3(Predicted)
[pka]

1.56±0.20(Predicted)
[InChI]

InChI=1S/C12H16ClN3O2/c1-12(2,3)18-11(17)16-5-4-8-6-10(13)15-14-9(8)7-16/h6H,4-5,7H2,1-3H3
[InChIKey]

CVTRVHBUBORTKQ-UHFFFAOYSA-N
[SMILES]

C12CN(C(OC(C)(C)C)=O)CCC1=CC(Cl)=NN=2
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