KETANSERIN TARTRATE

About This Item

Molecular Formula	C₂₆H₂₈FN₃O₉
CAS Number	83846-83-7

FC-0873999

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Properties

Chemical Identifiers

IUPAC Name	2,3-dihydroxybutanedioic acid;3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-1H-quinazoline-2,4-dione
SMILES	C1CN(CCC1C(=O)C2=CC=C(C=C2)F)CCN3C(=O)C4=CC=CC=C4NC3=O.C(C(C(=O)O)O)(C(=O)O)O
InChI Key	KMTLTEVOQLMYRS-UHFFFAOYSA-N
InChI	InChI=1S/C22H22FN3O3.C4H6O6.H2O/c23-17-7-5-15(6-8-17)20(27)16-9-11-25(12-10-16)13-14-26-21(28)18-3-1-2-4-19(18)24-22(26)29;5-1(3(7)8)2(6)4(9)10;/h1-8,16H,9-14H2,(H,24,29);1-2,5-6H,(H,7,8)(H,9,10);1H2

Physical Properties

Boiling Point	780.4ºC at 760 mmHg
Flash Point	425.8ºC

Safety Information

Hazard Class

Danger

Flash Point

425.8ºC

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.