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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>10</sub>H<sub>10</sub>ClFO

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Extracted from

Scheme 1 Scheme 2 Scheme 3

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₁₀H₁₀ClFO
Molecular Weight	200.64 g/mol
Exact Mass	200.0404 Da
InChI	InChI=1S/C10H10ClFO/c11-7-1-2-10(13)8-3-5-9(12)6-4-8/h3-6H,1-2,7H2
InChIKey	HXAOUYGZEOZTJO-UHFFFAOYSA-N
SMILES	C(CC(=O)C1=CC=C(C=C1)F)CCl
Number of Atoms	23
Number of H-Bond Acceptors	1
Number of H-Bond Donors	0
Atoms in the Largest π-System	8
XLogP	1.7

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