Octyltin trichloride
기본 정보
- CAS
3091-25-6- 표준 SMILES
CCCCCCC[CH2][Sn]([Cl])([Cl])[Cl]- InChIKey
INTLMJZQCBRQAT-UHFFFAOYSA-K- 분자식
- C8H17Cl3Sn
- 평균 분자량
- 338.3 g/mol
- 단동위원소 질량
- 337.94177828
개요
Mono-n-octyltin trichloride 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)
이름 및 식별자
- 우선 이름
- Octyltin trichloride
- IUPAC
- trichloro(octyl)stannane
- 영어명
- Octyltrichlorotin
- 분자식
- C8H17Cl3Sn
- 분자량
- 338.29
이름 및 동의어
Octyltin trichloridetrichloro(octyl)stannaneStannane, trichlorooctyl-OctyltrichlorotinTrichlorooctylstannaneMono-n-octyltin trichlorideStannane, octyltrichloro-Monooctyltin trichlorideMono-n-octyl-zinn-trichloridEINECS 221-435-4UNII-D5LF90P46QMono-n-octyl-zinn-trichlorid [German]
이름 더 보기
OCTYLTINCHLORIDEN-OCTYLTRICHLOROTINoctyl-titrichloriden-Octyltin-trichloriOctyltrichlorotin(IV)MonooctyltintrichloridN-OCTYLTIN-TRICHLORIDEoctyltrichloro-stannanoctyltrichlorostannane
NSC 297508D5LF90P46QNSC-297508TIN, TRICHLOROOCTYL-DTXSID3029659EC 221-435-4nOctyltrichlorotinMOTCl
데이터베이스 식별자
- CAS
3091-25-6- PubChem CID
- 76538
- DTXSID
DTXSID3029659- UNII
- D5LF90P46Q
- EC Number
- 221-435-4
물성
구조 계산 물성
- 극성 표면적
- 0 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 0
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 101
실험 및 물리화학적 성질
Chemical ClassesMetals -> Tin Compounds, Organic
Vapor Pressure0.004 [mmHg]
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description
Liquid; Liquid; Other Solid
Colorless liquid; [OECD SIDS] Pale yellow liquid; [Alfa Aesar MSDS]
물리화학적 성질
- 끓는 점
- 150 · 150-159°C 10mm
- 밀도
- 1 · 1,35 g/cm3
- 증기압
- 2.67 hPa · 2.67hPa at 100℃
- 인화점
- 121 °C · >121°C
- 용해도
- 클로로포름(가용성), 에틸아세테이트(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 기름
- 색상
- 무색~담황색
- Specific Gravity
- 1.35 · 1.35
- 수용성
- 330 μg/L · 330μg/L at 20℃
- 안정성
- 흡습성, 수분 민감성
- InChI
- InChI=1S/C5H5F7O4/c6-1(2(13,14)4(7,8)9)3(15,16)5(10,11)12/h1,13-16H
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 12.5% (3 of 24) of reports.
Danger
H315 (87.5%): Causes skin irritation [Warning Skin corrosion/irritation]
P203, P260, P264, P264+P265, P273, P280, P302+P352, P305+P354+P338, P317, P318, P319, P321, P332+P317, P362+P364, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 24 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
유해성 정보
Regulatory Information
Chemical: Stannane, trichlorooctyl-
Stannane, trichlorooctyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Stannane, trichlorooctyl- 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: 23-07-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/13860
Other Safety InformationIMAP assessments - Stannane, trichlorooctyl-: Human health tier II assessment
Hazards Summary
Reacts with water forming monooctyltin oxide and hydrogen chloride; Always produced as a mixture with dioctyltin dichloride (DOTC, CAS# 3542-36-7); [OECD SIDS] Reacts with water; Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Alfa Aesar MSDS] See Dichlorodioctylstannane.
Hazard Classes and Categories
Skin Irrit. 2 (87.5%)
Eye damage - category 1
안전 및 보호
화학 및 산업
약리 정보
Metabolism/Metabolites
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)
용도 및 제조
Uses
Used as an intermediate for organotin compounds; The thioglycolate ester is used as a heat stabilizer for polyvinyl chloride (PVC) and chlorinated PVC (CPVC) with applications including indirect food contact products, sheets, injection mouldings, pipes, sidings, and other rigid PVC products; [OECD SIDS]
U.S. Production2023: 1,000,000 - <8,500,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesIntermediate
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing
Stannane, trichlorooctyl-: ACTIVE
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