2,4'-Dimethyl-3-piperidinopropiophenonhydrochlorid

Tolperisone Hydrochloride

HCID 92965

Grundinformationen

CAS
3644-61-9
Standard-SMILES
Cc1ccc(C(=O)C(C)CN2CCCCC2)cc1.Cl
InChIKey
ZBUVYROEHQQAKL-UHFFFAOYSA-N
Summenformel
C16H24ClNO
Durchschnittliche Molmasse
281,82 g/mol
Monoisotopische Masse
281,15464207

Überblick

Tolperisone hydrochloride is an aromatic ketone.

Namen und Bezeichner

Bevorzugter Name
Tolperisone Hydrochloride
IUPAC
2-methyl-1-(4-methylphenyl)-3-piperidin-1-ylpropan-1-one;hydrochloride
Lokaler Name
2,4'-Dimethyl-3-piperidinopropiophenonhydrochlorid
Englischer Name
Tolperisone hydrochloride
Summenformel
C16H24ClNO
Molmasse
281.82

Namen und Synonyme

Tolperisone hydrochloride3644-61-9Tolperisone HClMidocalmMuscalmMydocalmArantoickAtmosgenBesnolineIsocalmKineorlMetosomin
Weitere Namen anzeigen
Abbsa2,4'-Dimethyl-3-piperidinopropiophenone hydrochlorideDTXSID20458682-methyl-1-(4-methylphenyl)-3-(1-piperidinyl)-1-Propanone hydrochloride2-Methyl-3-piperidino-1-p-tolylpropan-1-one hydrochlorideN-553BIOCALMMINACALM

Datenbank-Bezeichner

CAS
3644-61-9、70312-00-4
PubChem CID
92965
DTXSID
DTXSID2045868
ChEMBL
CHEMBL1395150
ChEBI
CHEBI:32244
UNII
8Z075K2TIG
EC Number
222-876-5

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
20,3 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
4
Schwere Atome
19

Experimentelle und physikochemische Eigenschaften

Collision Cross Section160.5 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

Physikochemische Eigenschaften

Schmelzpunkt
181 · 181-183°C
storage temp.
room temp
Löslichkeit
2 O: · H2O: >20mg/mL
Aggregatzustand
solid
Farbe
white
PH
pH(50g/l, 25℃) : 4.5~5.5

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 96 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Sicherheitsdaten

wgk
3
RTECS-Nr.
UH1575500
risk_code
20/21/22-52/53-36/37/38
Toxizität
LD50 s.c. in mice: 620 mg/kg (Porszasz, 1961)
hazard_code
Xn,Xi
safety_code
26-36-45-61-36/37-37/39

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological Classification · 1 Eintrag

A heterogeneous group of drugs used to produce muscle relaxation, excepting the neuromuscular blocking agents. They have their primary clinical and therapeutic uses in the treatment of muscle spasm and immobility associated with strains, sprains, and injuries of the back and, to a lesser degree, injuries to the neck. They have been used also for the treatment of a variety of clinical conditions that have in common only the presence of skeletal muscle hyperactivity, for example, the muscle spasms that can occur in MULTIPLE SCLEROSIS. (From Smith and Reynard, Textbook of Pharmacology, 1991, p358)

Anwendungen

VerwendenTolperisone hydrochloride can be used as a muscle relaxant.

Vor- und nachgelagerte Produkte

Anbieter101 Anbieter

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
艾吉析科技(上海)有限公司17717235263 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

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2

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