基本情報
- 標準SMILES
CCCCCCC[CH2][Sn](=[O])[CH2]CCCCCCC- InChIKey
LQRUPWUPINJLMU-UHFFFAOYSA-N- 分子式
- C16H34OSn
- 平均分子量
- 361.2 g/mol
- 単同位体質量
- 362.16316041
名称と識別子
- 優先名称
- Dioctyltin oxide
- IUPAC
- dioctyl(oxo)tin
- 現地名
- ジ-n-オクチルすずオキシド
- 英語名
- Dioctyltin oxide
- 分子式
- C16H34OSn
- 分子量
- 361.15
名称と別名
名称をさらに表示
データベース識別子
- CAS
870-08-6- PubChem CID
- 93563
- DTXSID
DTXSID6029628- UNII
- 643Q9V5VLS
- EC Number
- 212-791-1
- Nikkaji
- J7.149H
物性
構造計算による物性
- 極性表面積
- 17.1 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 1
- 回転可能結合数
- 14
- 重原子数
- 18
- 形式電荷
- 0
- 複雑度
- 162
実験および物理化学的性質
物理化学的性質
- 融点
- 245 · 245-248°C (dec.)
- 比重(密度)
- 1 · 1,3 g/cm3
- 蒸気圧
- 0.01 hPa · <0.01 hPa (20 °C)
- 闪点
- 70 °C · 70°C
- 貯蔵温度
- 30 °C · Store below +30°C.
- 溶解性
- トルエン(微量)
- 外見
- 粉
- 色
- 白い
- 比重
- 1.3 · 1.30
- 水溶解度
- 不溶性
- 沸点
- 230 °C · 230°C (1013 hPa)
- InChI
- 1S/2C8H17.O.Sn/c2*1-3-5-7-8-6-4-2;;/h2*1,3-8H2,2H3;;
- InChIKey
- LQRUPWUPINJLMU-UHFFFAOYSA-N
- SMILES
- [Sn](=O)(CCCCCCCC)CCCCCCCC
- LogP
- 6 at · 6 at 20℃
- CAS データベース
- 870 · 870-08-6(CAS DataBase Reference)
- EPAの化学物質情報
- Stannane, dioctyloxo- (870-08-6)
化学的性質
化学的特性white to almost white crystalline powder. It is practically insoluble in water but soluble in organic solvents.
安全と法規制
GHS分類
GHS Classification
Danger
H361 (58.8%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]
P203, P260, P264, P270, P273, P280, P308+P316, P318, P319, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 362 reports by companies from 20 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H361d: Suspected of damaging the unborn child [Warning Reproductive toxicity]
危険有害性情報
Regulatory Information
Chemical: Stannane, dioctyloxo-
Stannane, dioctyloxo- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Stannane, dioctyloxo- 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: 04-07-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/15870
Dioctyltin oxide: 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.
Hazard Classes and Categories
Repr. 2 (58.8%)
Specific target organ toxicity (repeated exposure) - category 1
安全データ
- wgk
- WGK 2 water endangering
- tsca
- TSCA listed
- rtecs
- WH7620000
- ridadr
- UN3146
- 毒性
- LD50 orally in Rabbit: 2500 mg/kg
- PRTR法
- 第一種指定化学物質
- hs_code
- 29310095
- risk_code
- 36/37/38
- hazard_code
- Xi
- safety_code
- 37/39-26-24/25
- hazard_class
- 6.1
- packing_group
- III
- 自然発火温度
- >100 °C
- 環境リスク評価
- ジオクチルスズオキシド(DOTO)(870-08-6)
- Hazard Classifications
- Aquatic Chronic 4
- ストレージクラス
- 6.1C - Combustible, acute toxic Cat.3toxic compounds or compounds which causing chronic effects
化学と産業
用途と製造
General Manufacturing Information
Adhesive Manufacturing
Stannane, dioctyloxo-: ACTIVE
応用分野
用途有機合成(ポリ塩化ビニル安定剤)原料。
使用Dioctyltin oxide is used as a stabilizer and as a widely applicable catalyst, especially for esterification reactions, transesterification reactions and condensation reactions. It is slightly less reactive than dibutyltin oxide, but is not subject to as many regulatory restrictions, which is why it is increasingly used. Dioctyloxotin can also be used in various chemical synthesis such as in preparation of trinuclear seven-coordinated tin complexes, having possible antioxidant, and anti-inflammatory activity.
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