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テトラキス(N,N-ジメチルジチオカルバミド酸)セレン(IV)

Selenium dimethyldithiocarbamate

HCID 8951
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
144-34-3
標準SMILES
CN(C)C(=S)S[Se](SC(=S)N(C)C)(SC(=S)N(C)C)SC(=S)N(C)C
InChIKey
HXKCUQDTMDYZJD-UHFFFAOYSA-N
分子式
C12H24N4S8Se
平均分子量
559.9 g/mol
単同位体質量
559.89319

概要

Methyl selenac is a thiocarbonyl compound.

名称と識別子

優先名称
Selenium dimethyldithiocarbamate
IUPAC
[tris(dimethylcarbamothioylsulfanyl)-λ4-selanyl] N,N-dimethylcarbamodithioate
現地名
テトラキス(N,N-ジメチルジチオカルバミド酸)セレン(IV)
英語名
Selenium dimethyldithiocarbamate
分子式
C12H24N4S8Se
分子量
559.83

名称と別名

Methyl selenacSELENIUM DIMETHYLDITHIOCARBAMATE144-34-3Selenium tetrakis(dimethyldithiocarbamate)HSDB 2929Selenium, tetrakis(dimethyldithiocarbamato)-EINECS 205-624-910C3RYF6QGTetrakis(dimethylcarbamodithioato-S,S')seleniumTatrakis(dimethyl carbamodithioato-S,S')seleniumSelenium, tetrakis(dimethylcarbamodithioato-S)-, (T-4)-Carbamodithioic acid, dimethyl-, tetraanhydrosulfide with orthothioselenious acid
名称をさらに表示
メチルセレナックテトラキス(N,N-ジメチルジチオカルバミド酸)セレン(IV)セレナックメチルt-4)-seleniutetrakis(dimethyldithiocarbamato)-seleniutetrakis(dimethylcarbamodithioato-s,s’)seleniumtatrakis(dimethylcarbamodithioato-s,s’)seleniumTetrakis(N,N-dimethyldithiocarbamic acid)selenium(IV) saltdimethyl-carbamodithioicacitetraanhydrosulfidewithorthothioseleniousac
METHYL SELENAC [IARC]Carbamodithioic acid, N,N-dimethyl-, tetraanhydrosulfide with orthothioselenious acidDTXSID9021263Tetrakis(dimethyldithiocarbamato)-seleniumSELENIUM DIMETHYLDITHIOCARBAMATE [HSDB]METHYL SELENAC (IARC)N,N-dimethyl({tris[(dimethylcarbamothioyl)sulfanyl]-lambda4-selanyl}sulfanyl)carbothioamideN,N-dimethyl((tris((dimethylcarbamothioyl)sulfanyl)-lambda4-selanyl)sulfanyl)carbothioamide

データベース識別子

CAS
144-34-3
PubChem CID
8951
DTXSID
DTXSID9021263
ChEBI
CHEBI:82494
UNII
10C3RYF6QG
EC Number
205-624-9
Nikkaji
J54.315B

物性

構造計算による物性

極性表面積
243 Ų
水素結合供与体数
0
水素結合受容体数
8
回転可能結合数
8
重原子数
25
形式電荷
0
複雑度
430

実験および物理化学的性質

PolymersPlastics & Rubber -> Dithiocarbamates (Rubber)
Density1.58
Color/FormYELLOW POWDER OR CRYSTALS
SolubilitySLIGHTLY SOL IN CARBON DISULFIDE, BENZENE, CHLOROFORM; INSOL IN WATER, DILUTE CAUSTIC, GASOLINE
DecompositionWhen heated to decomp ... emits very toxic fumes of /selenium, sulfur oxides, and nitrogen oxides/.
Melting Point140-172 °C
Physical DescriptionYellow solid; [HSDB] Yellow powder; [MSDSonline]

物理化学的性質

融点
140 · 140-172°C
比重(密度)
1 · 1,58 g/cm3
酸解離定数(Pka)
0.78 · 0.78±0.50(Predicted)
外見
個体
比重
1.58 · 1.58
EPAの化学物質情報
Selenium dimethyldithiocarbamate (144-34-3)

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 100% (5 of 5) of all reports.

Not Classified

Aggregated GHS information provided per 5 reports by companies from 1 notifications to the ECHA C&L Inventory.

危険有害性情報

Hazards Summary · 1 件

Contains selenium, which is toxic; [Sax] May cause irritation; Inhalation of dust and ingestion may be harmful; [MSDSonline] As indicated by its synonym, selenium dimethyldithiocarbamate, methyl selenac is related to the dithiocarbamate fungicides. Several of the dialkyldithiocarbamates are known skin sensitizers; See Carba mix. See Maneb. See Selenium.

Special Reports · 5 件

Toxicology Review: Clinical Toxicology 5 (2): 175 (1972)

WHO; Evaluation of The Available Toxicity Data On Selenium (1987). Properties and analysis; sources, levels and transport in the environment; human exposure; metabolism; animal studies; effects on man; evaluation of the health risks; quantitative assessment of exposure.

NTIS; Govt Reports Announcements & Index (GRA&I), Issue 14 (1987). This bibliography contains citations concerning the toxicity, carcinogenicity, environmental pollution, and other hazards and adverse effects of selenium. The detection, characterization, analytical methods, and removal from the environment are discussed. Pollution from coal fired and geothermal power plants are considered. (This updated bibliography contains 349 citations, none of which are new entries to the previous edition.)

Najael; Revue g'en'erale de s'ecurite - RGS 63: 65-72 (1987). Information note on the harmful effects of selenium compounds. Physical and chemical properties of selenium and its principal compounds; uses; pathology and toxicology (irritation of the skin and mucous membranes; these irritations are compensable under French law); radioactive selenium; fire hazards; French regulations; protection.

For more Special Reports (Complete) data for SELENIUM DIMETHYLDITHIOCARBAMATE (10 total), please visit the HSDB record page.

RCRA Requirements · 1 件

D010; A solid waste containing selenium (such as selenium dimeethyldithiocarbamate) may or may not become characterized as a hazardous waste when subjected to the Toxicity Characteristic Leaching Procedure listed in 40 CFR 261.24, and if so characterized, must be managed as a hazardous waste.

OSHA StandardsPermissible Exposure Limit: Table Z-1 8-Hr Time Weighted Avg: 0.2 mg/cu m. /Selenium cmpd (as Se)/
Atmospheric Standards · 1 件

Listed as a hazardous air pollutant (HAP) generally known or suspected to cause serious health problems. The Clean Air Act, as amended in 1990, directs EPA to set standards requiring major sources to sharply reduce routine emissions of toxic pollutants. EPA is required to establish and phase in specific performance based standards for all air emission sources that emit one or more of the listed pollutants. Selenium dimethyldithiocarbamate is included on this list.

EPA Hazardous Waste NumberD010; A waste containing selenium dimethyldithiocarbamate may (or may not) be characterized a hazardous waste following testing for the toxicity characteristics as prescribed by the Resource Conservation and Recovery Act (RCRA) regulations.
NIOSH RecommendationsRecommended Exposure Limit: 10 Hr Time-Weighted Avg: 0.2 mg/cu m. /Selenium/
Clean Water Act RequirementsToxic pollutant designated pursuant to section 307(a)(1) of the Clean Water Act and is subject to effluent limitations. /Selenium and compounds/
Hazard Classes and CategoriesNot Classified
State Drinking Water Guidelines · 4 件

(AZ) ARIZONA 45 ug/l /Selenium/

(ME) MAINE 10 ug/l /Selenium/

(MN) MINNESOTA 30 ug/l /Selenium/

(CT) CONNECTICUT 10 ug/l /Selenium/

Federal Drinking Water StandardsEPA 50 ug/l /Selenium/
Hazardous Reactivities and IncompatibilitiesAcids, strong oxidizers, chromium trioxide, potassium bromate, cadmium. /Selenium/

安全と保護具

Disposal MethodsGenerators of waste (equal to or greater than 100 kg/mo) containing this contaminant, EPA hazardous waste number D010, must conform with USEPA regulations in storage, transportation, treatment and disposal of waste.
Preventive Measures · 2 件

The worker should immediately wash the skin when it becomes contaminated. /Selenium/

Work clothing that becomes wet or significantly contaminated should be removed and replaced. /Selenium/

Minimum Risk LevelChronic Oral: 0.005 mg/kg/day (L134)
Threshold Limit Values (TLV) · 3 件

0.2 [mg/m3], as Se

8 hr Time Weighted Avg (TWA): 0.2 mg/cu m. /Selenium and compounds, as Se/

Excursion Limit Recommendation: Excursions in worker exposure levels may exceed 3 times the TLV-TWA for no more than a total of 30 minutes during a work day, and under no circumstances should they exceed 5 times the TLV-TWA, provided that the TLV-TWA is not exceeded. /Selenium and compounds, as Se/

Permissible Exposure Limit (PEL)0.2 [mg/m3], as Se
Personal Protective Equipment (PPE) · 5 件

Wear appropriate personal protective clothing to prevent skin contact. /Selenium/

Facilities for quickly drenching the body should be provided within the immediate work area for emergency use where there is a possibility of exposure. (Note: It is intended that these facilities provide a sufficient quantity or flow of water to quickly remove the substance from any body areas likely to be exposed. The actual determination of what constitutes an adequate quick drench facility depends on the specific circumstances. In certain instances, a deluge shower should be readily available, whereas in others, the availability of water from a sink or hose could be considered adequate.) /Selenium/

Recommendations for respirator selection. Max. concn for use: 1 mg/cu m. Respirator Class(es): Any dust and mist respirator. If not present as a fume. May require eye protection. Any dust, mist, and fume respirator. May require eye protection. Any air-purifying, full-facepiece respirator with a high-efficiency particulate filter. Any powered, air-purifying respirator with a dust and mist filter. If not present as a fume. May require eye protection. Any powered, air-purifying respirator with a dust, mist, and fume filter. May require eye protection. Any supplied-air respirator. May require eye protection. Any self-contained breathing apparatus with a full facepiece. /Selenium/

毒性情報

Health Effects · 1 件

Chronic oral exposure to high concentrations of selenium compounds can produce a disease called selenosis. The major signs of selenosis are hair loss, nail brittleness, and neurological abnormalities (such as numbness and other odd sensations in the extremities). Animal studies have shown that selenium may also affect sperm production and the female reproductive cycle. (L619)

Exposure RoutesOral (L619) ; inhalation (L619) ; dermal (L619)
Toxicity Summary · 1 件

Selenium readily substitutes for sulfur in biomolecules and in many biochemical reactions, especially when the concentration of selenium is high and the concentration of sulfur is low. Inactivation of the sulfhydryl enzymes necessary for oxidative reactions in cellular respiration, through effects on mitochondrial and microsomal electron transport, might contribute to acute selenium toxicity. Selenomethionine (a common organic selenium compound) also appears to randomly substitute for methionine in protein synthesis. This substitution may affect the structure and functionability of the protein, for example, by altering disulfide bridges. Inorganic forms of selenium appear to react with tissue thiols by redox catalysis, resulting in formation of reactive oxygen species and causing damage by oxidative stress. (L619)

Signs and Symptoms · 1 件

Short-term oral exposure to high concentrations of selenium may cause nausea, vomiting, and diarrhea. Brief exposures to high levels of elemental selenium or selenium dioxide in air can result in respiratory tract irritation, bronchitis, difficulty breathing, and stomach pains. Longer-term exposure to either of these air-borne forms can cause respiratory irritation, bronchial spasms, and coughing. (L619)

Natural Pollution Sources...NOT KNOWN TO OCCUR AS NATURAL PRODUCT.
Human Toxicity ExcerptsSUMMARY TOXICITY STATEMENT: HIGH BY /ACUTE/ ORAL ROUTE. CAPABLE OF CAUSING DEATH OR PERMANENT INJURY DUE TO EXPOSURES OF NORMAL USE; INCAPACITATING & POISONOUS; REQUIRES SPECIAL HANDLING.
Carcinogen Classification · 6 件

Methyl selenac

Group 3: Not classifiable as to its carcinogenicity to humans

法規制情報

RCRA Requirements · 1 件

D010; A solid waste containing selenium (such as selenium dimeethyldithiocarbamate) may or may not become characterized as a hazardous waste when subjected to the Toxicity Characteristic Leaching Procedure listed in 40 CFR 261.24, and if so characterized, must be managed as a hazardous waste.

Atmospheric Standards · 1 件

Listed as a hazardous air pollutant (HAP) generally known or suspected to cause serious health problems. The Clean Air Act, as amended in 1990, directs EPA to set standards requiring major sources to sharply reduce routine emissions of toxic pollutants. EPA is required to establish and phase in specific performance based standards for all air emission sources that emit one or more of the listed pollutants. Selenium dimethyldithiocarbamate is included on this list.

Clean Water Act RequirementsToxic pollutant designated pursuant to section 307(a)(1) of the Clean Water Act and is subject to effluent limitations. /Selenium and compounds/
State Drinking Water Guidelines · 4 件

(AZ) ARIZONA 45 ug/l /Selenium/

(ME) MAINE 10 ug/l /Selenium/

(MN) MINNESOTA 30 ug/l /Selenium/

(CT) CONNECTICUT 10 ug/l /Selenium/

Federal Drinking Water StandardsEPA 50 ug/l /Selenium/

安全データ

tsca
TSCA listed
有毒物質データの
144-34-3(Hazardous Substances Data)

化学と産業

薬理情報

Metabolism/Metabolites · 1 件

Selenium may be absorbed through inhalation and ingestion, while some selenium compounds may also be absorbed dermally. Once in the body, selenium is distributed mainly to the liver and kidney. Selenium is an essential micronutrient and is a component of glutathione peroxidase, iodothyronine 5'-deiodinases, and thioredoxin reductase. Organic selenium is first metabolized into inorganic selenium. Inorganic selenium is reduced stepwise to the intermediate hydrogen selenide, which is either incorporated into selenoproteins after being transformed to selenophosphate and selenocysteinyl tRNA or excreted into the urine after being transformed into methylated metabolites of selenide. Elemental selenium is also methylated before excretion. Selenium is primarily eliminated in the urine and feces, but certain selenium compounds may also be exhaled. (L619)

用途と製造

Uses · 3 件

Used as a vulcanization accelerator; [HSDB]

Vulcanization accelerator

Selenium rarely occurs in its elemental state in nature and is usually found in sulfide ores such as pyrite, partially replacing the sulfur in the ore matrix. It may also be found in silver, copper, lead, and nickel minerals.

U.S. Production · 2 件

(1972) PROBABLY GREATER THAN 4.54X10+5 GRAMS

(1975) PROBABLY GREATER THAN 4.54X10+5 GRAMS

Consumption PatternsESSENTIALLY 100% AS ACCELERATOR FOR RUBBER VULCANIZATION
Methods of Manufacturing · 2 件

REACTION OF DIMETHYLAMINE, CARBON DISULFIDE AND SELENIUM DIOXIDE IN AN ALCOHOLIC SOLUTION.

...PREPN OF WATER-INSOLUBLE DIALKYLDITHIOCARBAMATE METAL SALTS IS PPTN OF METAL SALT FROM AQ PREPN OF SODIUM DIALKYLDITHIOCARBAMATE.

Formulations/PreparationsTECHNICAL PRODUCT: ...PARTICLE SIZE, 99.9% PASSES THROUGH A 100-MESH SCREEN; SELENIUM CONTENT, 13-15%; MOISTURE, 1% MAX; ASH, 0.75% MAX. ...ALSO AVAILABLE FOR RUBBER PROCESSING IN DISPERSION CONTAINING 30% ETHYLENE-PROPYLENE RUBBER BINDER.
General Manufacturing Information · 3 件

Carbamodithioic acid, N,N-dimethyl-, tetraanhydrosulfide with orthothioselenious acid: ACTIVE

COMMERCIAL PRODN...FIRST REPORTED IN US IN 1946... IN 1974, ONLY 1 MFR REPORTED PRODN... IT IS NOT PRODUCED COMMERCIALLY IN EUROPE.

METHYL SELENAC IS USED IN RUBBER-PROCESSING INDUST AS ACCELERATOR TO PRODUCE DESIRED PHYSICAL PROPERTIES IN VULCANIZED RUBBER IN SHORTER CURING TIME & AT LOWER SULFUR LEVELS THAN WITH CONVENTIONAL ACCELERATORS. IT IS USED IN COMPOUNDING HEAT-RESISTANT NATURAL & SYNTHETIC RUBBERS.

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このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート

Recommendations for respirator selection. Condition: Emergency or planned entry into unknown concentrations or IDLH conditions: Respirator Class(es): Any self-contained breathing apparatus that has a full facepiece and is operated in a pressure-demand or other positive pressure-mode. Any supplied-air respirator that has a full facepiece and is operated in a pressure-demand or other positive-pressure mode in combination with an auxiliary self-contained breathing apparatus operated in pressure-demand or other positive-pressure mode. /Selenium/

Recommendations for respirator selection. Condition: Escape from suddenly occurring respiratory hazards: Respirator Class(es): Any air-purifying, full-facepiece respirator with a high-efficiency particulate filter. Any appropriate escape-type, self-contained breathing apparatus. /Selenium/

Immediately Dangerous to Life or Health (IDLH) · 2 件

1.0 [mg/m3], as Se

1 mg/cu m (as Se) /Selenium/

Volume 12: (1976) Some Carbamates, Thiocarbamates and Carbazides

1987

1987

3, not classifiable as to its carcinogenicity to humans. (L135)

Non-Human Toxicity Excerpts · 3 件

...18 MALE &...FEMALE (C57BL/6XC3H/ANF)F1.../&/ (C57BL/6XAKF)F1 MICE...GIVEN SINGLE SC INJECTIONS OF 464 MG/KG...ON 28TH DAY.../&/ OBSERVED UNTIL...ABOUT 78 WK OF AGE...13, 15, 18 & 17...RESPECTIVELY WERE STILL ALIVE. TUMOR INCIDENCES...COMPARED WITH...141, 154, 161 & 157...CONTROLS...WERE NOT INCR...FOR ANY TUMOR TYPE...

...18 MALE...& FEMALE (C57BL/6XC3H/ANF)F1 MICE...RECEIVED...10 MG/KG...AT 7 DAYS OF AGE BY STOMACH TUBE...DAILY UP TO 4 WK...SUBSEQUENTLY...34 MG/KG OF DIET ...EXPT...TERMINATED...ABOUT 78 WK...13 /&/ 17...MICE...RESPECTIVELY... STILL ALIVE. ...TUMORS...IN 4/17 MALES /RETICULUM-CELL SARCOMAS/ & 0/17 FEMALES...

...18 MALE...& FEMALE (C57BL/6XAKR)F1 MICE RECEIVED...10 MG/KG...AT 7 DAYS OF AGE BY STOMACH TUBE...DAILY UP TO 4 WK...SUBSEQUENTLY...34 MG/KG OF DIET ... EXPT...TERMINATED...ABOUT 78 WK...18 & 17...RESPECTIVELY...ALIVE. ...TUMORS... IN 1/18 MALES /RETICULUM-CELL SARCOMA/ & 2/17 FEMALES...(1 HEPATOMA & 1 RENAL ADENOMA).

Evidence for CarcinogenicityNo data are available in humans. Inadequate evidence of carcinogenicity in animals. OVERALL EVALUATION: Group 3: The agent is not classifiable as to its carcinogenicity to humans.