Grundinformationen
- CAS
522-51-0- Standard-SMILES
Cc1cc(N)c2ccccc2[n+]1CCCCCCCCCC[n+]1c(C)cc(N)c2ccccc21.[Cl-].[Cl-]- InChIKey
LTNZEXKYNRNOGT-UHFFFAOYSA-N- Summenformel
- C30H40Cl2N4
- Durchschnittliche Molmasse
- 527,6 g/mol
- Monoisotopische Masse
- 526,2630027
Überblick
Dequalinium chloride is an organic chloride salt that is the dichloride salt of dequalinium. It has a role as an antineoplastic agent, an antifungal agent, a mitochondrial NADH:ubiquinone reductase inhibitor and an antiseptic drug. It contains a dequalinium.
Namen und Bezeichner
- Bevorzugter Name
- Dequalinium Chloride
- IUPAC
- 1-[10-(4-amino-2-methylquinolin-1-ium-1-yl)decyl]-2-methylquinolin-1-ium-4-amine dichloride
- Lokaler Name
- Dechaliniumchlorid
- Englischer Name
- Dequalinium chloride
- Summenformel
- C30H40Cl2N4
- Molmasse
- 527.57
Namen und Synonyme
dequalinium chloride522-51-0Dequalinium DichlorideDecamineDekaminDecaminumChlorure de dequaliniumDequalinii chloridumBAQD 10NordmanCloruro de decalinio1,1'-Decamethylenebis(4-aminoquinaldinium chloride)
Weitere Namen anzeigen
DECADequalinium chloride for performance test CRSdequadinDequalinumdequafunganDequalinium chloride CRSDEQUALINIUM CHLORIDE HYDRATEefisolevazol
Dequalinio cloruroFLUOMIZINDTXSID3045144XYS8INN1I6BAQD-10GNF-Pf-5483Cloruro de decualinio1,10-Decamethylene-bis(4-aminoquinaldinium chloride)
Datenbank-Bezeichner
- CAS
522-51-0- PubChem CID
- 10649
- DTXSID
DTXSID3045144- ChEMBL
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 59,8 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 11
- Schwere Atome
- 36
- Formalladung
- 0
- Komplexität
- 532
Experimentelle und physikochemische Eigenschaften
CosmeticsOral care; Deodorant; Antiplaque; Antimicrobial
Physikochemische Eigenschaften
- Schmelzpunkt
- 300 °C · ≥300 °C(lit.)
- storage temp.
- 2 · 2-8°C
- Löslichkeit
- Slightly soluble in water and in ethanol (96 per cent).
- Aggregatzustand
- Solid
- Farbe
- Beige
- Merck
- 13 · 13,2930
- Stabilität
- 2 years · Stable for 2 years as supplied. Solutions in DMSO or distilled water may be stored at -20° for up to 3 months.
- Major Application
- pharmaceutical (small molecule)
- Kosmetik-Inhaltsstoffe Funktionen
- ANTIMICROBIALANTIPLAQUEDEODORANTORAL CARE
- InChIKey
- LTNZEXKYNRNOGT-UHFFFAOYSA-N
- SMILES
- C12C=CC=CC1=C(C=C(C)[N+]=2CCCCCCCCCC[N+]1C(C)=CC(N)=C2C=CC=CC=12)N.[Cl-].[Cl-]
- CAS Datenbank
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 1.5% (1 of 67) of reports.
Warning
H315 (98.5%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 67 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory InformationDequalinium chloride: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesSkin Irrit. 2 (98.5%)
Sicherheitsdaten
- F
- 8
- wgk
- 3
- RTECS-Nr.
- VA0700000
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 26-36-37/39
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationSubstances used on humans and other animals that destroy harmful microorganisms or inhibit their activity. They are distinguished from DISINFECTANTS, which are used on inanimate objects.
Verwendung und Herstellung
Use ClassificationCosmetics -> Oral care; Deodorant; Antiplaque; Antimicrobial
Anwendungen
BeschreibungDequalinium Chloride is a a potent and selective non-peptide blocker of the apamin-sensitive small conductance Ca2+-activated K+ channel (IC50 = 1.1 mM).
VerwendenDequalinium Chloride is a quaternary ammonium cation and the active ingredient in various medications including antiseptic and anti-malarial agents.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Anbieter100 Anbieter
北京华美互利生物化工010-56205725 · [email protected]
湖北威德利化学试剂有限公司186-02735115 18062128043 · [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
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