Grundinformationen
- Standard-SMILES
CCCCCCCC[N+](C)(C)CCCCCCCC.[Cl-]- InChIKey
FARBQUXLIQOIDY-UHFFFAOYSA-M- Summenformel
- C18H40ClN
- Durchschnittliche Molmasse
- 306 g/mol
- Monoisotopische Masse
- 305,284928
Namen und Bezeichner
- Bevorzugter Name
- Dioctyldimethylammonium chloride
- IUPAC
- dimethyl(dioctyl)azanium chloride
- Lokaler Name
- Dimethyldioctylammoniumchlorid
- Englischer Name
- Bisoctyl dimethyl ammonium chloride
- Summenformel
- C18H40ClN
- Molmasse
- 305.97
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
5538-94-3- PubChem CID
- 62581
- DTXSID
DTXSID6035491- ChEMBL
CHEMBL2357351- ChEBI
CHEBI:183784- UNII
- 0X0RL40Y6H
- EC Number
- 226-901-0
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 14
- Schwere Atome
- 20
- Formalladung
- 0
- Komplexität
- 157
Experimentelle und physikochemische Eigenschaften
Physical Description
Liquid
Viscous liquid; [BDH Laboratory Supplies]
Physikochemische Eigenschaften
- Schmelzpunkt
- 75 °C · 75 °C
- Siedepunkt
- 208.52 ℃[at · 208.52℃[at 101 325 Pa]
- Dichte
- 0.926 · 0.926[at 20℃]
- Dampfdruck
- 0.001 Pa · 0.001Pa at 20℃
- storage temp.
- Refrigerator
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- Farbe
- Colourless to Off-White
- Wasserlöslichkeit
- 250 mg/L · 250mg/L at 25℃
- InChI
- InChI=1S/C18H40N.ClH/c1-5-7-9-11-13-15-17-19(3,4)18-16-14-12-10-8-6-2;/h5-18H2,1-4H3;1H/q+1;/p-1
- InChIKey
- FARBQUXLIQOIDY-UHFFFAOYSA-M
- SMILES
- [N+](C)(C)(CCCCCCCC)CCCCCCCC.[Cl-]
- LogP
- 0.1 at · 0.1 at 21℃
- CAS Datenbank
- 5538 · 5538-94-3(CAS DataBase Reference)
- EPA chemische Informationen
- Dimethyl dioctyl ammonium chloride (5538-94-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 0.4% (1 of 242) of reports.
Danger
H301 (62.8%): Toxic if swallowed [Danger Acute toxicity, oral];H302 (36.8%): Harmful if swallowed [Warning Acute toxicity, oral];H310 (62.4%): Fatal in contact with skin [Danger Acute toxicity, dermal];H314 (99.6%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation];H318 (62.4%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H400 (90.1%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard];H410 (57.4%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
P260, P262, P264, P264+P265, P270, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 242 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Reported as not meeting GHS hazard criteria per 1 of 242 reports by companies.;There are 9 notifications provided by 241 of 242 reports by companies with hazard statement code(s).;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Gefahrenhinweise
Regulatory Information
Chemical: 1-Octanaminium, N,N-dimethyl-N-octyl-, chloride
Hazard Traits - Hazard Trait Undefined;Authoritative List - CECBP - Priority Chemicals;Report - if used as a fragrance or flavor ingredient
1-Octanaminium, N,N-dimethyl-N-octyl-, chloride (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Octanaminium, N,N-dimethyl-N-octyl-, chloride (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
2004/129/EC
Status: Active Update: 27-09-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/24263
1-Octanaminium, N,N-dimethyl-N-octyl-, chloride: 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.
Regulatorische Informationen
Regulatory Information
Chemical: 1-Octanaminium, N,N-dimethyl-N-octyl-, chloride
Hazard Traits - Hazard Trait Undefined;Authoritative List - CECBP - Priority Chemicals;Report - if used as a fragrance or flavor ingredient
1-Octanaminium, N,N-dimethyl-N-octyl-, chloride (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Octanaminium, N,N-dimethyl-N-octyl-, chloride (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
2004/129/EC
Status: Active Update: 27-09-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/24263
1-Octanaminium, N,N-dimethyl-N-octyl-, chloride: 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.
Sicherheitsdaten
- tsca
- TSCA listed
- ridadr
- 2810
- hs_code
- 29239000
- hazard_class
- 6.1(b)
- packing_group
- III
Chemie und Industrie
Verwendung und Herstellung
Uses
Used as an antimicrobial for hard surfaces, laundry, carpets, agricultural equipment, food handling facilities, medical equipment, water storage and purification equipment, swimming pools, industrial water systems (recirculating cooling water, drilling muds, oil well injection, and wastewater), and as a wood preservative; [Reference #1]
Petroleum Production and Refining [Category: Industry];Applying Wood Preservatives [Category: Other];Using Disinfectants or Biocides [Category: Clean];Sewer and Wastewater Treatment [Category: Industry]
General Manufacturing Information
Miscellaneous Manufacturing
1-Octanaminium, N,N-dimethyl-N-octyl-, chloride (1:1): ACTIVE
Anwendungen
VerwendenBardac(R) LF is a quaternary ammonium based antimicrobial used as a bacteriostat, disinfectant and/or a microbiocide. Bardac(R) LF is ideal for recirculating water systems where control of undesirable microbes without excessive foam is essential.
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