N,N'-(Decan-1,10-diyldi-1(4H)-pyridyl-4-yliden)bis(octylammonium)dichlorid
Octenidine Hydrochloride
Grundinformationen
- CAS
70775-75-6- Standard-SMILES
CCCCCCCCN=c1ccn(CCCCCCCCCCn2ccc(=NCCCCCCCC)cc2)cc1.Cl.Cl- InChIKey
SMGTYJPMKXNQFY-UHFFFAOYSA-N- Summenformel
- C36H62N4.2ClH
- Durchschnittliche Molmasse
- 623,8 g/mol
- Monoisotopische Masse
- 622,4508034
Überblick
See also: Octenidine (has active moiety).
Namen und Bezeichner
- Bevorzugter Name
- Octenidine Hydrochloride
- IUPAC
- N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]pyridin-4-imine;dihydrochloride
- Lokaler Name
- N,N'-(Decan-1,10-diyldi-1(4H)-pyridyl-4-yliden)bis(octylammonium)dichlorid
- Englischer Name
- Octenidine dihydrochloride
- Summenformel
- C36H64Cl2N4
- Molmasse
- 623.82616
Namen und Synonyme
70775-75-6OCTENIDINE HYDROCHLORIDEOctenidine HClSensidin doWin 41464-2octenidermOctenidolLAS189962LAS-189962WIN-41464-2U84956NU4BDTXSID90221025
Weitere Namen anzeigen
Octenidine DiHClN,N'-(decane-1,10-diyldi-1(4H)-pyridyl-4-ylidene)bis(octylammonium) dichlorideSOT360Otinidine hydrochlorideocenidine dihydrochlorideOrtinidine dihydrochlorideOctenidineDihydrochloride>Octenidine dihydrochloride 97%
RefChem:856047DTXCID90143516N,N'-(1,10-decanediyldi-1-(4H)-pyridinyl-4-ylidene)bis-(1-octamine) dihydrochloride274-861-8Octenidine dihydrochlorideOctenidine (dihydrochloride)1-Octanamine,N,N'-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2)1,1'-(Decane-1,10-diyl)bis(N-octylpyridin-4(1H)-imine) dihydrochloride
Datenbank-Bezeichner
- CAS
70775-75-6- PubChem CID
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 31,2 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 25
- Schwere Atome
- 42
- Formalladung
- 0
- Komplexität
- 691
Physikochemische Eigenschaften
- Schmelzpunkt
- 215 · 215-217℃
- Dichte
- 1.046 · 1.046[at 20℃]
- Dampfdruck
- 0 Pa · 0Pa at 25℃
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- Löslichkeit
- Soluble in dimethyl sulfoxide and methanol.
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
- Wasserlöslichkeit
- 14.2 g/L · 14.2g/L at 20℃
- Merck
- 14 · 14,6754
- Stabilität
- Hygroscopic
- Kosmetik-Inhaltsstoffe Funktionen
- ANTIMICROBIAL
- InChIKey
- SMGTYJPMKXNQFY-UHFFFAOYSA-N
- SMILES
- [N+]1(CCCCCCCCCC[N+]2C=CC(NCCCCCCCC)=CC=2)=CC=C(NCCCCCCCC)C=C1.[Cl-].[Cl-]
- LogP
- 1.5 at · 1.5 at 23℃
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 1.4% (1 of 70) of reports.
Warning
H302 (98.6%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 70 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: 1-Octanamine, N,Nâ²-(1,10-decanediyldi-1(4H)-pyridinyl-4-ylidene)bis-, hydrochloride (1:2)
REACH registered substance: N,N'-(decane-1,10-diyldi-1(4H)-pyridyl-4-ylidene)bis(octylammonium) dichloride (EC: 274-861-8)
Octenidine hydrochloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesAcute Tox. 4 (98.6%)
Sicherheitsdaten
- hs_code
- 2933399990
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological Classification
Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection.
Substances 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
Household ProductsInformation on 5 consumer products that contain Octenidine Hcl in the following categories is provided:
Anwendungen
BeschreibungThe antiseptic agent octenidine dihydrochloride (OCT) was developed by Sterling Winthrop (WIN41464-2) in the 1980s as an alternative to the anti-plaque agent CHX and successfully tested in vitro and in vivo. OCT has a broad spectrum of activity with similar effectiveness against Gram-negative and Gram-positive bacteria, fungi, and yeasts. Moreover, it has been shown that it may effectively interfere with the co-aggregation of dental plaque microbial colonizers without disturbing the normal, healthy oral flora. In a standardized comparison of antimicrobial activity ofthe antiseptic agents triclosan, polyvinylpyrrolidone-iodine, OCT, polyhexamethylene biguanide, and Chlorhexidine digluconat (CHX) using the min-imal effective concentration and minimum bactericidal con-centration, OCT was the most effective active agent of alltested antimicrobial substances. In other studies, the antibacterial and antiplaque efficacy of OCT was equal to or even greater than that of CHX[1].
VerwendenOctenidine dihydrochloride is used as a antiseptic for skin, mucous Membranes and wounds.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
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