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1648791-23-4

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1648791-23-4 Structure

1648791-23-4 Structure
IdentificationBack Directory
[Name]

Cycloocta[b]pyridine, 2-(4-ethyl-1-piperazinyl)-4-[4-(4-ethyl-1-piperazinyl)phenyl]-5,6,7,8,9,10-hexahydro-
[CAS]

1648791-23-4
[Synonyms]

BlonserinImpurity1
Blonanserin Impurity 2 DiHCl
Bunanseline Related Substance 1 Reference
2-(4-ethylpiperazin-1-yl)-4-(4-(4-ethylpiperazin-1-yl)phenyl)
Cycloocta[b]pyridine, 2-(4-ethyl-1-piperazinyl)-4-[4-(4-ethyl-1-piperazinyl)phenyl]-5,6,7,8,9,10-hexahydro-
[Molecular Formula]

C29H43N5
[MOL File]

1648791-23-4.mol
[Molecular Weight]

461.69
Chemical PropertiesBack Directory
[Boiling point ]

649.2±55.0 °C(Predicted)
[density ]

1.068±0.06 g/cm3(Predicted)
[pka]

8.57±0.20(Predicted)
[InChI]

InChI=1S/C29H43N5/c1-3-31-15-19-33(20-16-31)25-13-11-24(12-14-25)27-23-29(34-21-17-32(4-2)18-22-34)30-28-10-8-6-5-7-9-26(27)28/h11-14,23H,3-10,15-22H2,1-2H3
[InChIKey]

VGLORHMSNAOAAT-UHFFFAOYSA-N
[SMILES]

C12CCCCCCC1=C(C1=CC=C(N3CCN(CC)CC3)C=C1)C=C(N1CCN(CC)CC1)N=2
Hazard InformationBack Directory
[Uses]

Blonanserin Impurity 1 is a useful research chemical compound used in the synthesis of blonanserin impurities.
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