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146-54-3

146-54-3 structural image
Product Name: triflupromazine
Formula: C18H19F3N2S
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form VISCOUS, LIGHT AMBER-COLORED, LIQ, WHICH CRYSTALLIZES ON PROLONGED STANDING INTO LARGE IRREGULAR CRYSTALS
Boiling Point 176 °C @ 0.7 MM HG
Solubility SOL IN WATER, ALC, & ACETONE; INSOL IN ETHER /HCL/
LogP 5.54
LogS -5.3
Stability/Shelf Life SOLN ARE SENSITIVE TO AIR & LIGHT /HYDROCHLORIDE/
Refractive Index INDEX OF REFRACTION: 1.5780 @ 23 °C/D
Kovats Retention Index 2212 2210 2240 2238 2220 2211 2231 2220.8 2221.1 2239 2235 2275 2232.1 2256.5
Other Experimental Properties SLIGHT, CHARACTERISTIC ODOR; MELTS BETWEEN 170 & 178 °C /HYDROCHLORIDE/

COMPUTED DESCRIPTORS

Molecular Weight 352.4 g/mol
XLogP3 5.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 4
Exact Mass 352.12210427 g/mol
Monoisotopic Mass 352.12210427 g/mol
Topological Polar Surface Area 31.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 416
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Triflupromazine is a member of the class of phenothiazines that is 10H-phenothiazine having a trifluoromethyl subsitituent at the 2-position and a 3-(dimethylamino)propyl group at the N-10 position. It has a role as a dopaminergic antagonist, an antiemetic, a first generation antipsychotic and an anticoronaviral agent. It is a tertiary amine, a member of phenothiazines and an organofluorine compound. It derives from a hydride of a 10H-phenothiazine.