bis(trifluoromethanesulfonyloxy)cerio trifluoromethanesulfonate

• ChemBase编号: 97297
• 分子式: C3CeF9O9S3
• 平均质量: 587.3233288
• 单一同位素质量: 586.76151156
• SMILES: [Ce](OS(=O)(=O)C(F)(F)F)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
• Canonical SMILES: FC(S(=O)(=O)O[Ce](OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F)(F)F
• InChI: InChI=1S/3CHF3O3S.Ce/c3*2-1(3,4)8(5,6)7;/h3*(H,5,6,7);/q;;;+3/p-3
• InChIKey: PHSMPGGNMIPKTH-UHFFFAOYSA-K

名称和登记号

名称

• IUPAC标准名: bis(trifluoromethanesulfonyloxy)cerio trifluoromethanesulfonate
• IUPAC传统名: bis(trifluoromethanesulfonyloxy)cerio trifluoromethanesulfonate
• 别名: Cerium(III) trifluoromethanesulphonate 99%

登记号

• CAS号: 76089-77-5
• MDL号: MFCD02093899
• PubChem SID: 162083908
• PubChem CID: 10952045

理论计算性质

• 质子受体: 6
• 质子供体: 0
• LogD (pH = 5.5): 5.1582
• LogD (pH = 7.4): 5.1582
• Log P: 5.1582
• 摩尔折射率: 47.3025 cm^3
• 极化性: 28.444916 Å^3
• 极化表面积: 130.11 Å^2
• 可自由旋转的化学键: 9
• 里宾斯基五规则: false

分子性质

理化性质

• 闪点: none°C

安全信息

• 保存注意事项: Irritant