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Dichlordioctylstannan

Dioctyltin dichloride

HCID 77080
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Grundinformationen

CAS
3542-36-7
Standard-SMILES
CCCCCCC[CH2][Sn]([Cl])([Cl])[CH2]CCCCCCC
InChIKey
SBOSGIJGEHWBKV-UHFFFAOYSA-L
Summenformel
C16H34Cl2Sn
Durchschnittliche Molmasse
416,1 g/mol
Monoisotopische Masse
416,10595115

Überblick

Di-n-octyltin dichloride is an organotin compound. Tin is a chemical element with the symbol Sn and atomic number 50. It is a natural component of the earth's crust and is obtained chiefly from the mineral cassiterite, where it occurs as tin dioxide. (L307, L309)

Namen und Bezeichner

Bevorzugter Name
Dioctyltin dichloride
IUPAC
dichloro(dioctyl)stannane
Lokaler Name
Dichlordioctylstannan
Englischer Name
DI-N-OCTYLTIN DICHLORIDE
Summenformel
C16H34Cl2Sn
Molmasse
416.06

Namen und Synonyme

3542-36-7DichlorodioctyltinDi-n-octyltin dichlorideDioctyltin dichlorideStannane, dichlorodioctyl-DichlorodioctylstannaneDOTCDi-n-octyltindichlorideDioctylstannium dichlorideTZ52I3CR3QDIOCTYLDICHLOROTINNSC-102574
Weitere Namen anzeigen
dichlorodioctyl-stannanDiocyldichlorotinDIOCTYLTINCHLORIDEDioctylzinndichloriddioctyl-tidichloridedioctyltindichloride
RefChem:586055222-583-2Di-n-OctyldichlorotinDichloro(dioctyl)stannaneStannane, dioctyldichloro-Di-n-octyl-zinn dichloridTin, dioctyl-, dichlorideDi-n-Octyltin-dichloride

Datenbank-Bezeichner

CAS
3542-36-7
PubChem CID
77080
DTXSID
DTXSID2029662
UNII
TZ52I3CR3Q

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
0 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
0
Frei drehbare Bindungen
14
Schwere Atome
19
Formalladung
0
Komplexität
166

Experimentelle und physikochemische Eigenschaften

Chemical ClassesMetals -> Tin Compounds, Organic
Vapor Pressure0.0000039 [mmHg]
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description · 2 Einträge

Liquid; Liquid; Other Solid

White solid; [OECD SIDS] Crystalline solid; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
46 · 46-48°C
Siedepunkt
175 °C · 175°C 1mm
Dichte
1 · 1,175 g/cm3
Dampfdruck
0.001 Pa · 0.001Pa at 25℃
Flammpunkt
204 °C · 204°C
Aggregatzustand
solid
Wichte
1.17 · 1.17
Wasserlöslichkeit
Insoluble in water.
CAS Datenbank

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 · 6 Einträge

Danger

H330: Fatal if inhaled [Danger Acute toxicity, inhalation]

P203, P260, P264, P270, P271, P273, P280, P284, P304+P340, P316, P318, P319, P320, P403+P233, P405, and P501 (click each P-code to see the statement)

Danger

H314 (18.2%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P203, P260, P264, P270, P271, P273, P280, P284, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P318, P319, P320, P321, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Stannane, dichlorodioctyl-

Hazard Traits - Reproductive Toxicity

Stannane, dichlorodioctyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Stannane, dichlorodioctyl- 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)

Status: Active Update: 19-08-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/14165

Other Safety InformationIMAP assessments - Stannane, dichlorodioctyl-: Human health tier II assessment
Hazards Summary · 1 Eintrag

The thioglycolate ester isomers are dioctyltin bis(2-ethylhexyl thioglycolate) CAS# 15571-58-1 and dioctyltin bis(isooctyl thioglycolate) CAS# 26401-97-8; [OECD SIDS] An irritant; Toxic by ingestion, inhalation, and skin absorption; [Alfa Aesar MSDS] See Tin, organic compounds. See Trichlorooctylstannane.

Hazard Classes and Categories · 4 Einträge

Acute Tox. 2 (77.3%)

Acute toxicity (inhalation) - category 2

Chemie und Industrie

Pharmakologische Informationen

Metabolism/Metabolites · 1 Eintrag

Though tin metal is very poorly absorbed, tin compounds may be absorbed via oral, inhalation, or dermal routes, with organotin compounds being much more readily absorbed than inorganic tin compounds. Tin may enter the bloodstream and bind to hemoglobin, where it is distributed and accumulates mainly in the kidney, liver, lung, and bone. Organotin compounds may undergo dealkylation, hydroxylation, dearylation, and oxidation catalyzed by cytochrome P-450 enzymes in the liver. The alkyl products of dealkylation are conjugated with glutathione and further metabolized to mercapturic acid derivatives. Tin and its metabolites are excreted mainly in the urine and feces. (L308)

Verwendung und Herstellung

Uses · 1 Eintrag

Always produced as a mixture with monooctyltin trichloride (MOTC, CAS# 3091-25-6); Used as a heat stabilizer for polyvinyl chloride (PVC) and chlorinated PVC (CPVC) with applications including films (including indirect food contact), sheets, injection mouldings, pipes, and sidings; [OECD SIDS]

U.S. Production2023: 1,000,000 - <8,500,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesIntermediate
General Manufacturing Information · 2 Einträge

All Other Chemical Product and Preparation Manufacturing

Stannane, dichlorodioctyl-: ACTIVE

Anwendungen · 1 Eintrag

VerwendenDi-n-octyldichlorotin compounds are used as intermediates in the production of other organotin chemicals. Metatin and Acima. These products are also used as catalysts or industrial intermediates in the production of polyurethanes, silicone resins, synthetic lubricants, and MS polymer sealants.

Zugehörige Reaktionen

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Reaktionsgleichung von HRID 1073483
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Reaktionsgleichung von HRID 1224183
HRID 1224183als EduktTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaktionsgleichung von HRID 2332904
HRID 2332904als EduktTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

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EC Number
222-583-2
3542 · 3542-36-7(CAS DataBase Reference)
EPA chemische Informationen
Stannane, dichlorodioctyl- (3542-36-7)

Acute toxicity (Inhalation: Dusts and mists) - Category 2

Repr. 1B

Sicherheit und Schutzausrüstung

Exposure Control and Personal Protection0.1 [mg/m3], inhalable fraction, as Sn[German Research Foundation (DFG)]
Threshold Limit Values (TLV) · 2 Einträge

0.1 [mg/m3], as Sn

0.2 [mg/m3], as Sn

Permissible Exposure Limit (PEL)0.1 [mg/m3], as Sn
Immediately Dangerous to Life or Health (IDLH)25.0 [mg/m3], as Sn

Toxikologische Informationen

Health EffectsBreathing or swallowing, or skin contact with organotins, can interfere with the way the brain and nervous system work, causing death in severe cases. Organic tin compounds may also damage the immune and reproductive system. (L307, L308)
Adverse EffectsNeurotoxin - Other CNS neurotoxin
Exposure RoutesOral (L308) ; inhalation (L308) ; dermal (L308)
Toxicity Summary · 1 Eintrag

Organotin compounds produce neurotoxic and immunotoxic effects. Organotins may directly activate glial cells contributing to neuronal cell degeneration by local release of pro-inflammatory cytokines, tumor necrosis factor-_, and/or interleukins. They may also induce apoptosis by direct action on neuronal cells. Organotin compounds stimulate the neuronal release of and/or decrease of neuronal cell uptake of neurotransmitters in brain tissue, including aspartate, GABA, glutamate, norepinephrine, and serotonin. This may be either a contributing factor to or result of the neuronal cell loss. The immunotoxic effects of organotins are characterized by thymic atrophy caused by the suppression of proliferation of immature thymocytes and apoptosis of mature thymocytes. Organotin compounds are believed to exert these effects by suppressing DNA and protein synthesis, inducing the expression of genes involved in apoptosis (such as nur77), and disrupting the regulation of intracellular calcium levels, giving rise to the uncontrolled production of reactive oxygen species, release of cytochrome c to the cytosol, and the proteolytic and nucleolytic cascade of apoptosis. The suppression of proliferation of immature thymocytes further results in the suppression of T-cell-mediated immune responses. Organotins are also endocrine disruptors and are believed to contribute to obesity by inappropriate receptor activation, leading to adipocyte differentiation. Inorganic tin triggers eryptosis, contributing to tin-induced anemia. (L308, A182, A184)

Signs and SymptomsInorganic or organic tin compounds placed on the skin or in the eyes can produce skin and eye irritation. (L308)
Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).
Toxicity DataLC50 (rat) = 390 mg/m3/1hr (particle sizes = 3-10 microns)

Sicherheitsdaten

tsca
TSCA listed
ridadr
3146
hs_code
29319090
risk_code
36/37/38-48/20/22
safety_code
26-35-36/37/39
hazard_class
6.1
packing_group
II