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1259059-77-2

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1259059-77-2 Structure

1259059-77-2 Structure
IdentificationBack 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 PropertiesBack 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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