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New synthesis of a late-stage tetracyclic key intermediate of lumateperone

Mátyás Milen, Bálint Nyulasi, Tamás Nagy, Gyula Simig and Balázs Volk

Beilstein J. Org. Chem. 2022, 18, 653–659. https://doi.org/10.3762/bjoc.18.66

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Chemical structure C<sub>4</sub>H<sub>12</sub>N<sub>2</sub>

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Extracted from

Scheme 2

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₄H₁₂N₂
Molecular Weight	88.15 g/mol
Exact Mass	88.1001 Da
InChI	InChI=1S/C4H12N2/c1-5-3-4-6-2/h5-6H,3-4H2,1-2H3
InChIKey	KVKFRMCSXWQSNT-UHFFFAOYSA-N
SMILES	CNCCNC
Number of Atoms	18
Number of H-Bond Acceptors	2
Number of H-Bond Donors	2
Atoms in the Largest π-System	0
XLogP	-0.6

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