pentafluoropropanoyl 2,2,3,3,3-pentafluoropropanoate

• ChemBase编号: 9704
• 分子式: C6F10O3
• 平均质量: 310.046432
• 单一同位素质量: 309.96877606
• SMILES: FC(C(C(=O)OC(=O)C(C(F)(F)F)(F)F)(F)F)(F)F
• Canonical SMILES: O=C(C(C(F)(F)F)(F)F)OC(=O)C(C(F)(F)F)(F)F
• InChI: InChI=1S/C6F10O3/c7-3(8,5(11,12)13)1(17)19-2(18)4(9,10)6(14,15)16
• InChIKey: XETRHNFRKCNWAJ-UHFFFAOYSA-N

名称和登记号

名称

• IUPAC标准名: pentafluoropropanoyl 2,2,3,3,3-pentafluoropropanoate
• IUPAC传统名: pentafluoropropanoyl 2,2,3,3,3-pentafluoropropanoate
• 别名: 全氟丙酸酐; 五氟丙酸酐; Pentafluoropropionic anhydride; Perfluoropropionic anhydride; Pentafluoropropionic anhydride; Pentafluoropropionic anhydride; PFAA; Perfluoropropanoic anhydride 99%; PFPA

登记号

• CAS号: 356-42-3
• EC号: 206-604-2
• MDL号: MFCD00000429
• Beilstein号: 1806446
• PubChem SID: 24855205; 160973011
• PubChem CID: 67742

理论计算性质

• 质子受体: 2
• 质子供体: 0
• LogD (pH = 5.5): 3.3534234
• LogD (pH = 7.4): 3.3534234
• Log P: 3.3534234
• 摩尔折射率: 33.4384 cm^3
• 极化性: 13.209896 Å^3
• 极化表面积: 43.37 Å^2
• 可自由旋转的化学键: 6
• 里宾斯基五规则: true

分子性质

理化性质

• 沸点: 69-70 °C/735 mmHg(lit.); 69-70°C/735mm; 73-74°C; 73-74°C
• 闪点: none°C
• 密度: 1.571; 1.571 g/mL at 25 °C(lit.); 1.589
• 折射率: <1.3000

安全信息

• 保存条件: Room Temperature (15-30°C), Desiccate
• 保存注意事项: Corrosive/Stench/Moisture Sensitive/Store under Argon/Keep Cold; Moisture Sensitive; MOISTURE SENSITIVE, CORROSIVE
• 欧盟危险性物质标志: 腐蚀性(Corrosive) (C)
• 联合国危险货物编号: 3265; UN3265
• 德国WGK号: 3
• 联合国危险货物等级: 8
• 联合国危险货物包装类别(PG): 2; II
• 危险公开号: 14-34; 34; R:34
• 安全公开号: 20-23-26-36/37/39-45; 26-36/37/39-45; S:26-27/28-36/37/39-46-64
• TSCA收录: true; 是
• GHS危险品标识: GHS05
• GHS警示词: Danger
• GHS危险声明: H314; H314-H318
• GHS警示性声明: P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501A; P280-P305 + P351 + P338-P310
• 个人保护装置: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3265 8/PG 2
• 欧盟补充危害声明: Reacts violently with water.

产品相关信息

• 纯度: ≥97%; ≥96.0% (GC); ≥97.0% (GC); 98%; 99%
• 级别: purum
• 线性分子式: (CF3CF2CO)2O

详细说明

MP Biomedicals - 02198985

Purity: >97%
Clear, colorless liquid

Apollo Scientific Ltd - PC5750

Useful derivatising agent of amines, alcohols, etc for Electron-Capture GC detection, Anal. Chem,1984,56,1695

Sigma Aldrich - 77292

Other Notes
本品可酰化胺、氨基酸和其他化合物。PFPA 的衍生物具有高挥发性；用于气相色谱分离1,2,3

Sigma Aldrich - 252387

包装
5, 25 g in glass bottle

参考文献

• Reagent for the preparation of volatile pentafluoropropionyl derivatives of amines, alcohols, etc. for GC, sensitive to electron-capture detection: J. Chromat., 60, 134 (1971); 69, 157 (1972); 97, 19, 175 (1974); Anal. Chem., 56, 1695 (1984). For monographs on GC reagents, see: D. R. Knapp, Handbook of Analytical Derivatisation Reactions, Wiley, N.Y. (1979); Handbook of Derivatives for Chromatography, 2nd ed., K. Blau and J. M. Halket, Eds., Wiley, Chichester (1993).