Fupentixol dihydrochloride structure, CAS 2413-38-9

Fupentixol dihydrochloride

CAS Number2413-38-9

Synonyms(Z)-4-(3-(2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene)propyl)-1-piperazineethanol dihydrochloride; 1-Piperazineethanol, 4-[3-[2- (trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl]-, dihydrochloride; FUPENTIXOL DIHYDROCHLORIDE; FLUPENTIXOL DIHYDROCHLORIDE; Fluanxol dihydrochloride; EINECS 219-321-4; 1-Piperazineethanol, 4-[3-[2- (trifluoromethyl)thioxanthen-9-ylidene]propyl]-, dihydrochloride; Zimelidine dihydrochloride; Fupentixol HCl; flupentixolhydrochloride; 4-[3-[2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl]-1-piperazineethanol dihydrochloride; fx703

Molecular FormulaC23H27Cl2F3N2OS

Molecular Weight507.44

Purity98.00%

Density

Boiling Point554.7ºC at 760 mmHg

Melting Point

Flash Point

AppearanceWhite or off-white solid

EINECS

MSDSChineseEnglish

Symbol

Signal Word

Cat. No.: 2A-9028461 Purity: 98.00%
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Quality Control of [ 2413-38-9 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number2413-38-9
Catalog No.2A-9028461
Chinese Name盐酸氟喷己醇(盐酸氟哌噻吨)
Synonyms(Z)-4-(3-(2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene)propyl)-1-piperazineethanol dihydrochloride; 1-Piperazineethanol, 4-[3-[2- (trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl]-, dihydrochloride; FUPENTIXOL DIHYDROCHLORIDE; FLUPENTIXOL DIHYDROCHLORIDE; Fluanxol dihydrochloride; EINECS 219-321-4; 1-Piperazineethanol, 4-[3-[2- (trifluoromethyl)thioxanthen-9-ylidene]propyl]-, dihydrochloride; Zimelidine dihydrochloride; Fupentixol HCl; flupentixolhydrochloride; 4-[3-[2-(Trifluoromethyl)-9H-thioxanthen-9-ylidene]propyl]-1-piperazineethanol dihydrochloride; fx703
Molecular FormulaC23H27Cl2F3N2OS
Molecular Weight507.44
Purity98.00
Boiling Point554.7ºC at 760 mmHg
AppearanceWhite or off-white solid
Water SolubilityH2O: soluble | soluble
Storage ConditionDesiccate at RT
ApplicationFlupentixol dihydrochlorid, a thioxidone drug, is used in the treatment of schizophrenia and anti-anxiety and depressive disorders.
HTC2942000000
PubChem ID7849295
SMILESCl.Cl.OCCN1CCN(CCC=C2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1
InChIInChI=1S/C23H25F3N2OS.2ClH/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29;;/h1-2,4-8,16,29H,3,9-15H2;2*1H/b18-5-;;
InChI KeyIOVDQEIIMOZNNA-UHFFFAOYSA-N
Use ofFlupentixol dihydrochloride, a thioxanthene drug, is used in therapy of schizophrenia as well as in anxiolytic and depressive disorders. Properties Name Fupentixol dihydrochloride Synonym More Synonyms Fupentixol dihydrochloride Biological Activity Description Flupentixol dihydrochloride, a thioxanthene drug, is used in therapy of schizophrenia as well as in anxiolytic and depressive disorders. Related Catalog Signaling Pathways >> Others >> Others Research Areas >> Neurological Disease References [1]. Yonar D, et al. Effect of cis-(Z)-flupentixol on DPPC membranes in the presence and absence of cholesterol. Chem Phys Lipids. 2016 Jun;198:61-71. Chemical & Physical Properties Exact Mass 506.117310 PSA 52.01000 LogP 6.08150 InChIKey IOVDQEIIMOZNNA-UHFFFAOYSA-N Storage condition Desiccate at RT Water Solubility H2O: soluble | soluble Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : Thioxanthene, 9-(3-(4-(2-hydroxyethyl)piperazinyl)propylidene)-2-tr ifluoromethyl-, dihydrochloride CAS REGISTRY NUMBER : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : MOLECULAR WEIGHT : WISWESSER LINE NOTATION : T C666 BS IYJ FXFFF IU3- DT6M DNTJ C2Q &GH 2 HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,704,1982 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies. (Nippon Koteisho Kyokai, 12-15, 2-chome, Shibuya, Shibuya-ku, Tokyo 150, Japan) V.1- 1970- Volume(issue)/page/year: 4,90,1973 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies. (Nippon Koteisho Kyokai, 12-15, 2-chome, Shibuya, Shibuya-ku, Tokyo 150, Japan) V.1- 1970- Volume(issue)/page/year: 4,90,1973 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies. (Nippon Koteisho Kyokai, 12-15, 2-chome, Shibuya, Shibuya-ku, Tokyo 150, Japan) V.1- 1970- Volume(issue)/page/year: 4,90,1973 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies. (Nippon Koteisho Kyokai, 12-15, 2-chome, Shibuya, Shibuya-ku, Tokyo 150, Japan) V.1- 1970- Volume(issue)/page/year: 4,90,1973 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Behavioral - sleep REFERENCE : APTOA6 Acta Pharmacologica et Toxicologica. (Copenhagen, Denmark) V.1-59, 1945-86. For publisher information, see PHTOEH Volume(issue)/page/year: 19,87,1962 Safety Information Hazard Codes Xn:Harmful; RIDADR UN 2811 WGK Germany 3 RTECS TL9900000 HS Code 2942000000
Transport InfoProduct name: Flupenthexol hydrochloride (flupentixol hydrochloride)
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