基本情報
- CAS
4259-15-8- 標準SMILES
CCCCC(CC)COP(=S)([S-])OCC(CC)CCCC.CCCCC(CC)COP(=S)([S-])OCC(CC)CCCC.[Zn+2]- InChIKey
OECQDNKCDGGPFY-UHFFFAOYSA-L- 分子式
- C32H68O4P2S4Zn
- 平均分子量
- 772.5 g/mol
- 単同位体質量
- 770.276711
名称と識別子
- 優先名称
- Zinc bis[O,O-bis(2-ethylhexyl)] bis(dithiophosphate)
- IUPAC
- zinc bis(bis(2-ethylhexoxy)-sulfanylidene-sulfido-λ5-phosphane)
- 現地名
- ビス[ビス(2-エチルヘキシルオキシ)ホスフィノチオイルチオ]亜鉛
- 英語名
- zinc bis[O,O-bis(2-ethylhexyl)] bis(dithiophosphate)
- 分子式
- C32H72O4P2S4Zn
- 分子量
- 776.49
名称と別名
ZINC BIS(2-ETHYLHEXYL) PHOSPHORODITHIOATEEINECS 224-235-5UNII-08VKE04H4QZinc di(2-ethylhexyl) dithiophosphate08VKE04H4QPhosphorodithioic acid, O,O-di-2-ethylhexyl ester, zinc saltPhosphorodithioic acid, O,O-bis(2-ethylhexyl) ester, zinc saltZPTP 3DTXSID5027566ZINC BIS(O,O-BIS(2-ETHYLHEXYL)) BIS(DITHIOPHOSPHATE)EC 224-235-5ZINC, bis[O,O-bis(2-ethylhexyl) phosphorodithioato-kappaS,kappaS']-, (T-4)-
名称をさらに表示
ビス[ビス(2-エチルヘキシルオキシ)ホスフィノチオイルチオ]亜鉛＝ビス［Ｏ，Ｏビス（２エチルヘキシル）＝ジチオホスファト］（T-4）-ビス［O，O-ビス（2-エチルヘキシル） ホスホロジチオアト-κS，κS’］亜鉛O,O-ビス(2-エチルヘキシル) {[({ビス[(2-エチルヘキシル)オキシ](スルファニリデン)-λ5-ホスファニル}スルファニル)ジンシオ]スルファニル}ホスホノチオアートZinc-di(2-ethylhexyl)dithiophosphatezinc bis(2-ethylhexyl)dithiophosphateZINCBISOODI2ETHYLHEXYLDITHIOPHOSPHATEZinc bis[O,O-bis(2-ethylhexyl) dithiophosphate]Bis[bis(2-ethylhexyloxy)phosphinothioylthio]zinczinc bis(2-ethylhexoxy)-sulfido-thioxo-phosphorane
物性
構造計算による物性
- 極性表面積
- 103 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
- 28
- 重原子数
- 43
- 形式電荷
- 0
- 複雑度
- 255
実験および物理化学的性質
Chemical ClassesMetals -> Metals, Organic Compounds
Physical Description
Large Crystals; Liquid; Liquid
Liquid; [IUCLID] Amber liquid with an odor of alcohol; [MSDSonline]
物理化学的性質
- 蒸気圧
- 0 · 0-0.024Pa at 25-70℃
- 溶解性
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- 外見
- Viscous
- InChI
- InChI=1S/2C16H35O2PS2.Zn/c2*1-5-9-11-15(7-3)13-17-19(20,21)18-14-16(8-4)12-10-6-2;/h2*15-16H,5-14H2,1-4H3,(H,20,21);/q;;-2/p+2
- InChIKey
- YVNSKXQECPVKRT-UHFFFAOYSA-P
- SMILES
- O(P1(=S[Zn+2]2(S=P(OCC(CC)CCCC)(OCC(CC)CCCC)[SH-]2)[SH-]1)OCC(CC)CCCC)CC(CC)CCCC
- LogP
- 3.59 at · 3.59 at 22℃ and pH5
- 表面張力
- 63.7 mN/m · 63.7mN/m at 1.25g/L and 21℃
- EPAの化学物質情報
- Zinc, bis[O,O-bis(2-ethylhexyl) phosphorodithioato-.kappa.S,.kappa.S']-, (T-4)- (4259-15-8)
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
Danger
H318 (88.9%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P354+P338, P317, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 657 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: Phosphorodithioic acid, O,O-bis(2-ethylhexyl) ester, zinc salt
Zinc, bis[O,O-bis(2-ethylhexyl) phosphorodithioato-.kappa.S,.kappa.S']-, (T-4)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Zinc, bis[O,O-bis(2-ethylhexyl) phosphorodithioato-.kappa.S,.kappa.S']-, (T-4)- 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)
REACH registered substance: Zinc bis[O,O-bis(2-ethylhexyl)] bis(dithiophosphate) (EC: 224-235-5)
Zinc, bis[O,O-bis(2-ethylhexyl) phosphorodithioato-.kappa.S,.kappa.S']-, (T-4)-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Phosphorodithioic acid, O,O-bis(2-ethylhexyl) ester, zinc salt: Human health tier I assessment
Hazards SummaryA skin and eye irritant, based on animal studies; [IUCLID] A moderate skin irritant; A severe eye irritant that could cause permanent damage; [MSDSonline] See Zinc dialkyldithiophosphates.
Hazard Classes and CategoriesEye Dam. 1 (88.9%)
安全データ
- tsca
- TSCA listed
化学と産業
用途と製造
UsesUsed as a fuel additive and corrosion inhibitor in automotive and industrial lubricants; [IUCLID]
U.S. Production2023: 25,000,000 - <40,000,000 lb
Consumer UsesOther
Industry UsesOther
General Manufacturing Information
All Other Chemical Product and Preparation Manufacturing
Zinc, bis[O,O-bis(2-ethylhexyl) phosphorodithioato-.kappa.S,.kappa.S']-, (T-4)-: ACTIVE
応用分野
使用Zinc Bis(2-Ethylhexyl) Phosphorodithioate is an analytical standard with antioxidant properties.
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