Dioctadecyl dimethyl ammonium chloride
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Dioctadecyl dimethyl ammonium chloride
structure -
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CAS No:
107-64-2
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Formula:
C38H80ClN
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Chemical Name:
Dioctadecyl dimethyl ammonium chloride
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Synonyms:
quaternium5;quaternium-5;talofloc;varisoft100;DIMETHYLDISTEARYLAMMONIUM CHLORIDE;DIOCTADECYLDIMETHYLAMMONIUM CHLORIDE;DISTEARYLDIMETHYLAMMONIUM CHLORIDE;Di-(n-octadecyl) dimethylammonium chloride
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CAS No:
Description
light beige solidA powder cationic-quaternary fabricsoftener.
Liquid|POWDER.
light beige solid
A powder cationic-quaternary fabric softener.
Dioctadecyl dimethyl ammonium chloride Basic Attributes
586.5
585.598
3580288
203-508-2
OM9573ZX3X
1296
61374
TSCA listed
DTXSID8026771
Powder
29349990
Characteristics
0
log Kow= 3.80
Liquid
0.8274 (rough estimate)
72~122℃
700.52°C (rough estimate)
1.6000 (estimate)
Solubility in water: none
Keep in a cool, dry, dark location in a tightly sealed container or cylinder. Keep away from incompatible materials, ignition sources and untrained individuals. Secure and label area. Protect containers/cylinders from physical damage.
Vapour pressure, Pa at 25°C:
LD50 oral in rat: 11300mg/kg
1.5×102mol/(m3Pa) at 25℃, HSDB (2015)
Inert atmosphere,Room Temperature
Safety Information
Ⅲ
9
UN 3077 9/PG 3
2
Xi,N
24-26-39-46-60-61
BQ1923000
Xi,N
Stable. Incompatible with strong oxidizing agents. Combustible.
P273, P280, P305+P351+P338, P310, P391, P501
41-50/53
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.
UN 3077 9/PG 3
Combustible. Gives off irritating or toxic fumes (or gases) in a fire.
|Danger|H318: Causes serious eye damage [Danger Serious eye damage/eye irritation]|P273, P280, P305+P351+P338, P310, P391, and P501|H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|Aggregated GHS information provided by 222 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Not Classified
Use water in large amounts, powder, alcohol-resistant foam, carbon dioxide.
ACTIVATED-SLUDGE TREATMENT RESULTED IN 91.3% REMOVAL OF DIMETHYLDISTEARYLAMMONIUM CHLORIDE WITHOUT REDN OF THE ACTIVITY OF THE SLUDGE.
Vacuum spilled material with specialist equipment. If appropriate, moisten first to prevent dusting. Do NOT let this chemical enter the environment. Personal protection: particulate filter respirator adapted to the airborne concentration of the substance.
A harmful concentration of airborne particles can be reached quickly when dispersed.
The substance is corrosive to the eyes. The substance is irritating to the skin.
NO open flames, NO sparks and NO smoking.
Use local exhaust or breathing protection.
Protective gloves.
Wear safety goggles or eye protection in combination with breathing protection.
Toxicity
THE TOXICITY OF DISTEARYLDIMETHYLAMMONIUM CHLORIDE TO DAPHNIA MAGNA WAS REDUCED BY 32 TIMES IN THE PRESENCE OF LIGNIN. ENVIRONMENTAL COMPONENTS SUCH AS LINEAR ALKYLBENZENESULFONATE, FULVIC ACIDS, CHLORELLA VULGARIS CELLS, ACTIVATED SLUDGE, BENTONITE & SILICA GEL HAD SIMILAR EFFECT.
LD50 Rat oral 11,300 mg/kg
Dimethyldioctadecylammonium chloride's production and use as a retail powdered detergent-softener, in industrial laundry and pap-softening formulas, and in cosmetic formulations(1), as a flocculating agent(2), and in the monitoring of cationic surfactants in sewage treatment plants(3) may result in its release to the environment through various waste streams(SRC).
TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 1X10+10(SRC), determined from a log Kow of 3.80(2) and a regression-derived equation(3), indicates that dimethyldioctadecylammonium chloride is expected to be immobile in soil(SRC). Volatilization of dimethyldioctadecylammonium chloride from moist soil surfaces is not expected to be an important fate process(SRC) given an estimated Henry's Law constant of 6.4X10-8 atm-cu m/mole(SRC), using a fragment constant estimation method(4). Dimethyldioctadecylammonium chloride is not expected to volatilize from dry soil surfaces(SRC) based upon an estimated vapor pressure of 2.6X10-17 mm Hg(SRC), determined from a fragment constant method(5). In an OECD screening test, at a 2.5 mg/l concentration, dimethyldioctadecylammonium chloride degradation reaches over 90% in 2-4 days and at 10 mg/l concentration, a Zahn-Wellen test found degradation is nearly complete in 10 days(2).|AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 1X10+10(SRC), determined from a log Kow of 3.80(2) and a regression-derived equation(3), indicates that dimethyldioctadecylammonium chloride is expected to adsorb to suspended solids and sediment in water(SRC). Volatilization from water surfaces is not expected(3) based upon an estimated Henry's Law constant of 6.4X10-8 atm-cu m/mole(SRC), developed using a fragment constant estimation method(4). According to a classification scheme(5), an estimated BCF of 71(SRC), from a log Kow(2) and a regression-derived equation(6), suggests the potential for bioconcentration in aquatic organisms is moderate. Dimethyldioctadecylammonium chloride biodegradation in river water is found to take place in 4.9-13.8 days(7,8), and an OECD and Zahn-Wellens screening test found degradation takes place in 2-10 days(2).|ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), dimethyldioctadecylammonium chloride, which has an estimated vapor pressure of 2.6X10-17 mm Hg at 25 °C(SRC), using a fragment constant estimation method(2), is expected to exist solely in the particulate phase. Particulate-phase dimethyldioctadecylammonium chloride may be removed from the air by wet and dry deposition(SRC).
The rate constant for the vapor-phase reaction of dimethyldioctadecylammonium chloride with photochemically-produced hydroxyl radicals has been estimated as 6.9X10-13 cu m/molecule-sec at 25 °C(SRC) using a structure estimation method(1). This corresponds to an atmospheric half-life of about 5 hours at an atmospheric concentration of 5X10+5 hydroxyl radicals per cu cm(1).
An estimated BCF of 71 was calculated for dimethyldioctadecylammonium chloride(SRC), using a log Kow of 3.80(1) and a regression-derived equation(2). According to a classification scheme(3), this BCF suggests the potential for bioconcentration in aquatic organisms is low.
The Koc of dimethyldioctadecylammonium chloride is estimated as 1X10+10(SRC), using a log Kow of 3.80(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that dimethyldioctadecylammonium chloride is expected to be immobile in soil.
The Henry's Law constant for dimethyldioctadecylammonium chloride is estimated as 6.4X10-8 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This Henry's Law constant indicates that dimethyldioctadecylammonium chloride is expected to be essentially nonvolatile from water surfaces(2). Dimethyldioctadecylammonium chloride's Henry's Law constant(1) indicates that volatilization from moist soil surfaces will not occur(SRC). Dimethyldioctadecylammonium chloride is not expected to volatilize from dry soil surfaces(SRC) based upon a an estimated vapor pressure of 2.6X10-17 mm Hg(3), determined from a fragment constant method(3).
SURFACE WATER: In the 1980's, dimethyldioctadecylammonium was found at a concentration of 200-400 mg/kg in suspended solids from the basin of the Rhine River(1).
NIOSH (NOES Survey 1981-1983) has statistically estimated that 13,516 workers (6,145 of these are female) are potentially exposed to dimethyldioctadecylammonium chloride in the US(1). Occupational exposure to dimethyldioctadecylammonium chloride may occur through dermal contact with this compound at workplaces where dimethyldioctadecylammonium chloride is produced or used(SRC). The general population may be exposed via the use of consumer products containing this compound(SRC).
Drug Information
TOXICITY RATINGS: 3 AND 4. 3= MODERATELY TOXIC: PROBABLE ORAL LETHAL DOSE (HUMAN) 0.5-5 G/KG, BETWEEN 1 OZ AND 1 PINT (OR 1 LB) FOR 70 KG PERSON (150 LB). 4= VERY TOXIC: PROBABLE ORAL LETHAL DOSE (HUMAN) 50-500 MG/KG, BETWEEN 1 TEASPOON AND 1 OZ FOR 70 KG PERSON (150 LB). /CATIONIC DETERGENTS/
Substances that augment, stimulate, activate, potentiate, or modulate the immune response at either the cellular or humoral level. The classical agents (Freund's adjuvant, BCG, Corynebacterium parvum, et al.) contain bacterial antigens. Some are endogenous (e.g., histamine, interferon, transfer factor, tuftsin, interleukin-1). Their mode of action is either non-specific, resulting in increased immune responsiveness to a wide variety of antigens, or antigen-specific, i.e., affecting a restricted type of immune response to a narrow group of antigens. The therapeutic efficacy of many biological response modifiers is related to their antigen-specific immunoadjuvanticity. (See all compounds classified as Adjuvants, Immunologic.)|Agents that modify interfacial tension of water; usually substances that have one lipophilic and one hydrophilic group in the molecule; includes soaps, detergents, emulsifiers, dispersing and wetting agents, and several groups of antiseptics. (See all compounds classified as Surface-Active Agents.)|Substances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection. (See all compounds classified as Anti-Infective Agents.)
(14)C-LABELED DIOCTADECYLDIMETHYLAMMONIUM CHLORIDE DID NOT EFFECTIVELY PENETRATE RABBIT SKIN & HUMAN INFANT ABDOMINAL SKIN.
Fresh air, rest.
Remove contaminated clothes. Rinse skin with plenty of water or shower.
First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.
1-octadecanaminium, N,N-dimethyl-N-octadecyl-
Cough.
Redness. Pain.
Redness. Pain. Blurred vision. Severe deep burns.
Dioctadecyl dimethyl ammonium chloride Use and Manufacturing
The same as dimethyl hexadecyl ammonium chloride.
This product can be used as fabric softener, asphalt emulsifier, organic bentonite covering agent, and also used as an auxiliary for tertiary oil recovery. It can be applied to fabric softener, hair conditioner, release agent, etc. It has softening, conditioning and antistatic effects
Surface active agents
Laundry and dishwashing products
Dioctadecyl dimethyl ammonium chloride is a useful quaternary ammonium salt for proteomics research.
(1979) PROBABLY GREATER THAN 2.27X10+6 GRAMS|(1981) PROBABLY GREATER THAN 2.27X10+6 GRAMS|(1993) Separate statistics for this item are not published to avoid disclosure of individual company operations.
97% solids content
Soap, cleaning compound, and toilet preparation manufacturing|1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, chloride (1:1): ACTIVE|ARQUAD /IS/ TRADEMARK FOR A SERIES OF QUATERNARY AMMONIUM SALTS CONTAINING ONE OR TWO ALKYL GROUPS RANGING FROM C8-C18. APPLICATIONS: CORROSION INHIBITORS; EMULSIFIERS; GERMICIDES AND SANITIZING AGENTS; TEXTILE FABRIC SOFTENERS. /ARQUAD/|PPTN & MICROFLOTATION OF EGG ALBUMIN & OF HEMOGLOBIN WAS STUDIED AS A FUNCTION OF PH IN THE PRESENCE OF DIOCTADECYLDIMETHYLAMMONIUM CHLORIDE.
Cosmetics -> Antistatic; Hair conditioning
Computed Properties
Molecular Weight:586.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:34
Exact Mass:585.5979293
Monoisotopic Mass:585.5979293
Heavy Atom Count:40
Complexity:391
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
Drug Function and Efficacy
antistatic agent
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