1259059-77-2

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1259059-77-2 Structure

Identification	Back Directory
[Name] intermediate of Cenobamate
[CAS] 1259059-77-2
[Synonyms] Benzonatate Impurity 4 intermediate of Cenobamate (R)-1-(2-chlorophenyl)-2-(2H-tetrazol-2-yl)ethanol
[Molecular Formula] C9H9ClN4O
[MOL File] 1259059-77-2.mol
[Molecular Weight] 224.65

Chemical Properties	Back Directory
[Boiling point ] 422.1±55.0 °C(Predicted)
[density ] 1.47±0.1 g/cm3(Predicted)
[pka] 12.35±0.20(Predicted)
[InChI] InChI=1S/C9H9ClN4O/c10-8-4-2-1-3-7(8)9(15)5-14-12-6-11-13-14/h1-4,6,9,15H,5H2/t9-/m0/s1
[InChIKey] HMTCTAFOMZTQMS-VIFPVBQESA-N
[SMILES] N1=CN=NN1C[C@@H](C1=CC=CC=C1Cl)O

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