トリフルオロ酢酸パラジウム(II)

Palladium(II) trifluoroacetate

HCID 2733347

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基本情報

CAS: 42196-31-6
標準SMILES: O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F.[Pd+2]
InChIKey: PBDBXAQKXCXZCJ-UHFFFAOYSA-L
分子式: C4F6O4Pd
平均分子量: 332.45 g/mol
単同位体質量: 331.87356

名称と識別子

優先名称: Palladium(II) trifluoroacetate
IUPAC: palladium(2+);bis(2,2,2-trifluoroacetate)
現地名: トリフルオロ酢酸パラジウム(II)
英語名: PALLADIUM(II) TRIFLUOROACETATE
分子式: C4F6O4Pd
分子量: 332.45

名称と別名

Palladium(II) trifluoroacetate42196-31-6DTXSID50369856RefChem:367834DTXCID60320892628-066-1Palladium(II) 2,2,2-trifluoroacetatePALLADIUM TRIFLUOROACETATEMFCD00013204palladium(2+);2,2,2-trifluoroacetateTrifluoroacetic acid palladium(II) saltC4F6O4Pd

名称をさらに表示

トリフルオロ酢酸パラジウム(II)トリフルオロ酢酸パラジウム(II), 97%トリフルオロ酢酸パラジウム(II), min. 97%Pd(CF3COO)2bis(2,2,2-trifluoroacetoxy)palladiumadium(II) trifLuoroacetatePalladium(Ⅱ)TrifluoroacetatePalldium (II)TrifluoroacetatePalladium(II)Trifluoroacetate>

palladium(2+) ion ditrifluoroacetatePD(TFA)2Palladium(2+) bis(trifluoroacetate)PALLADIUM(2+) DITRIFLUOROACETATEPalladium(II)trifluoroacetatepalladium(II)trifluoro-acetateSCHEMBL204190palladium bis(trifluoroacetate)

データベース識別子

CAS: 42196-31-6
PubChem CID: 2733347
DTXSID: DTXSID50369856
EC Number: 628-066-1
Nikkaji: J1.053.953F

物性

構造計算による物性

極性表面積: 80.3 Å²
水素結合供与体数: 0
水素結合受容体数: 10
回転可能結合数: 0
重原子数: 15
形式電荷: 0
複雑度: 77

物理化学的性質

融点: 220 °C · ~220 °C
貯蔵温度: Inert atmosphere,Room Temperature
溶解性: エーテル、アセトンに可溶。ベンゼン、クロロホルム、トリフルオロ酢酸に不溶。
外見: 粉
色: 茶色
InChI: 1S/2C2HF3O2.Pd/c2*3-2(4,5)1(6)7;/h2*(H,6,7);/q;;+2/p-2
InChIKey: WEJWWPJAIXRLIJ-UHFFFAOYSA-M
SMILES: FC(F)(F)C(=O)O[Pd]OC(=O)C(F)(F)F
CAS データベース: 42196 · 42196-31-6(CAS DataBase Reference)

化学的性質

化学的特性tan to brown powder

安全と法規制

GHS分類

GHS Classification · 5 件

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.9%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

危険有害性情報

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.9%)

安全データ

F: 3-10
wgk: 3
tsca: No
hs_code: 28439000
risk_code: 36/37/38
hazard_code: Xi
hazard_note: Irritant
safety_code: 26-37/39
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 11 - Combustible Solids

化学と産業

応用分野 · 1 件

使用Palladium(II) Trifluoroacetate is a pallaium salt of Trifluoroacetic Acid (T786035), a solvent used in a variety of organic synthesis and chemical processes. Also used in the synthesis of anticancer agents as well as phospholipase D inhibitors.

調製方法 · 1 件

純化方法Suspend it in trifluoroacetic acid and evaporate it on a steam bath a couple of times. The residue is then dried in vacuum (40-80o) to give a brown powder. It is hygroscopic. [Stephenson et al. J Chem Soc 3632 1965, Trost & Metzner J Am Chem Soc 102 3572 1980.]