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Description

flupentixol · CAS 2709-56-0 · C23H25F3N2OS. UNII NS00076284.

Identification

CAS Registry Number	2709-56-0
PubChem CID	17012
Molecular formula	C23H25F3N2OS
IUPAC name	2-[4-[3-[2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol
UNII (FDA)	NS00076284

Computed Descriptors

Molecular Weight	434.5
XLogP3	4.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	434.16396908
Monoisotopic Mass	434.16396908
Topological Polar Surface Area	52
Heavy Atom Count	30
Formal Charge	0

Physical description & handling notes

• 199.4 Ų [M+H]+ [CCS Type: TW; Method: Major Mix IMS/Tof Calibration Kit (Waters)]

Synonyms

Flupentiol; 2-[4-[3-[2-(trifluoromethyl)-9-thioxanthenylidene]propyl]-1-piperazinyl]ethanol; Prestwick0_000340; Prestwick1_000340; SCHEMBL145726; SPBio_002300; orb1705077; CHEMBL4743867; SCHEMBL30596168; NJMYODHXAKYRHW-UHFFFAOYSA-N; MSK11374; NS00076284; Q27164953; (ez)-2-[4-[3-[2-(trifluoromethyl)thioxanthen-9-ylidene]propyl]piperazin-1-yl]ethanol; 2-(4-{3-[2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl}piperazin-1-yl)ethan-1-ol; (E)-2-(4-(3-(2-(trifluoromethyl)-9H-thioxanthen-9-ylidene)propyl)piperazin-1-yl)ethan-1-ol

Frequently Asked Questions

What are the CAS number and molecular formula of flupentixol?

CAS 2709-56-0; molecular formula C23H25F3N2OS; molecular weight — g/mol.

What other names is flupentixol known by?

Flupentiol, 2-[4-[3-[2-(trifluoromethyl)-9-thioxanthenylidene]propyl]-1-piperazinyl]ethanol, Prestwick0_000340, Prestwick1_000340, SCHEMBL145726, SPBio_002300.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.