Basic information
- CAS
102-30-7- Standard SMILES
CCCCCCCCCCCC[N+](C)(C)Cc1ccc(Cl)c(Cl)c1.[Cl-]- InChIKey
YWMSPYAVKFABPD-UHFFFAOYSA-M- Molecular formula
- C21H36Cl3N
- Average molar mass
- 408.9 g/mol
- Monoisotopic mass
- 407.19133319
Names & identifiers
- Preferred name
- Lauryldimethyl-3,4-dichlorobenzylammonium chloride
- IUPAC
- (3,4-dichlorophenyl)methyl-dodecyl-dimethylazanium chloride
- English name
- (3,4-dichlorobenzyl)dodecyldimethylammonium chloride
- Molecular formula
- C21H36Cl3N
- Molecular weight
- 408.88
Names & synonyms
Riseptin102-30-7Dynium chlorideDynaltoneAralkonium chlorideLauryldimethyldichlorobenzylammonium chlorideKo 18Lauryldimethyl-3,4-dichlorobenzylammonium chlorideEINECS 203-023-639B3IX0UZYDodecyldimethyl(3,4-dichlorobenzyl)ammonium chlorideBenzenemethanaminium, 3,4-dichloro-N-dodecyl-N,N-dimethyl-, chloride
Show more names
Ko18(3,4-dichlorobenzyl)dodecyldimethylammonium chlorideN-(3,4-Dichlorobenzyl)-N-dodecyl-N,N-dimethyl ammonium chloride
Ammonium, (3,4-dichlorobenzyl)dodecyldimethyl-, chloride3,4-Dichlorobenzyl-lauryl-dimethylammonium chlorideDTXSID9042091TetrosanKO-18DICHLOROBENZALKONIUM CHLORIDE3,4-DICHLOROBENZYL(DIMETHYL)DODECYLAMMONIUM CHLORIDELAURYLDIMETHYL(3,4-DICHLOROBENZYL)AMMONIUM CHLORIDE
Database identifiers
- CAS
102-30-7、1329-25-5、8023-53-8- PubChem CID
- 7605
- DTXSID
DTXSID9042091- UNII
- 39B3IX0UZY
- EC Number
- 203-023-6
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 306
Experimental & physicochemical properties
Chemical ClassesOther Uses -> Biocides/Disinfectants
TasteBitter
Color/FormColorless crystals
SolubilitySoluble in water, alcohol
DecompositionWhen heated to decomposition it emits very toxic fumes of /hydrogen chloride and nitrogen oxides/.
Physical DescriptionColorless solid; [Hawley]
Other Experimental PropertiesCationic
Physicochemical properties
- FDA UNII
- 39 B3IX0UZY · 39B3IX0UZY
- EPA Substance Registry System
- Lauryldimethyldichlorobenzylammonium chloride (102-30-7)
Safety & regulation
Hazard information
Regulatory InformationBenzenemethanaminium, 3,4-dichloro-N-dodecyl-N,N-dimethyl-, 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.
Hazards Summary
A skin irritant; [Hawley] A severe eye irritant; Toxic by ingestion and intravenous route; May cause liver and kidney damage; Oral LD50 (rat) = 730 mg/kg; [Sax] Allergic contact dermatitis is infrequently documented; [Marks, p. 266] Quaternary ammonium compounds have curare-like properties when concentrated solutions are ingested; Affected patients may have methemoglobinemia and hemolysis and die within 1-3 hours; Elevated liver function tests were reported; Concentrated solutions can cause burns; No data on carcinogenicity or teratogenicity; [IPCS-PIMs]
Skin, Eye, and Respiratory Irritations
Irritating to skin.
A severe eye irritant.
Safety & protection
Disposal Methods
SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
Preventive Measures
SRP: The scientific literature for the use of contact lenses in industry is conflicting. The benefit or detrimental effects of wearing contact lenses depend not only upon the substance, but also on factors including the form of the substance, characteristics and duration of the exposure, the uses of other eye protection equipment, and the hygiene of the lenses. However, there may be individual substances whose irritating or corrosive properties are such that the wearing of contact lenses would be harmful to the eye. In those specific cases, contact lenses should not be worn. In any event, the usual eye protection equipment should be worn even when contact lenses are in place.
Toxicology
Adverse EffectsNeurotoxin - Other CNS neurotoxin
Human Toxicity Excerpts
A deadly poison by ingestion. Poison by intravenous route. ... Can cause liver and kidney damage. A moderate allergen.
Irritating to skin.
A severe eye irritant.
Non-Human Toxicity Values
LD50 Rat oral 730 mg/kg
LD50 Mouse oral 2000 mg/kg
LD50 Mouse iv 50 mg/kg
LD50 Guines pig oral 316 ug/kg
Chemistry & industry
Uses & manufacturing
Uses
Used as algicide, antiseptic, and sterilant; [Hawley] Used as a germicide, algicide, and deodorant; [EPA OHM/TADS] Quaternary ammonium compounds are used as algaecides/slimicides (swimming pools, industrial water reservoirs, and farm ponds), antiseptics for cleaning wounds, antistatic agents for textiles, softeners for paper products, and pigment dispersers; [IPCS-PIMs]
Using Disinfectants or Biocides [Category: Clean]
As an antiseptic, algicide, and sterilant
Methods of ManufacturingReaction of N-dimethyldodecylamine with 3,4-dichlorobenzyl chloride
General Manufacturing InformationTetrosan 3,4 D. Alkyl dimethyl 3,4-dichlorobenzyl ammonium chloride in liquid form is manufactured by Millmaster-Onsk UK; (Malborough House, 30-2 Yarm Road, Stockton-on-Tees, Cleveland, England).
Applications
UsesAs sanitizer and deodorant.
Suppliers4 total
2A PharmaChem USA[email protected]
Leancare Ltd.[email protected]
CHEMICAL LAND21[email protected]
3B Scientific Corporation[email protected]
Related reactions
1 records
Compound notes
Loading…