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CAS No.: | 21907-50-6 |
---|---|
Name: | CESIUM TRIFLUOROACETATE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C2HF3O2.Cs |
Molecular Weight: | 245.921 |
Synonyms: | Aceticacid, trifluoro-, cesium salt (8CI,9CI);Cesium trifluoroacetate;CID11032147;PC2526; |
Density: | 2.00 g/cm3 at 20 °C |
Melting Point: | 114-116 °C |
Boiling Point: | 72.2 °C at 760 mmHg |
Solubility: | water: 2 M at 20 °C, clear, colorless |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26 |
PSA: | 40.13000 |
LogP: | -0.70140 |
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The Acetic acid,2,2,2-trifluoro-, cesium salt (1:1) with CAS registry number of 21907-50-6 is also known as Cesium trifluoroacetate. The IUPAC name is Cesium 2,2,2-trifluoroacetate. In addition, the formula is C2HF3O2.Cs and the molecular weight is 246.92. This chemical should be stored in sealed containers in cool, dry place and away from oxidizing agents.
Physical properties about Acetic acid,2,2,2-trifluoro-, cesium salt (1:1) are: (1)ACD/LogP: 1.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2; (4)ACD/LogD (pH 7.4): -3; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 37.3Å2; (13)Enthalpy of Vaporization: 34.62 kJ/mol; (14)Boiling Point: 72.2 °C at 760 mmHg; (15)Vapour Pressure: 96.2 mmHg at 25 °C.
When you are using this chemical, please be cautious about it. As a chemical, it is irritating to eyes, respiratory system and skin. What's more, it may cause inflammation to the skin or other mucous membranes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1. SMILES: [Cs+].FC(F)(F)C([O-])=O
2. InChI: InChI=1/C2HF3O2.Cs/c3-2(4,5)1(6)7;/h(H,6,7);/q;+1/p-1
3. InChIKey: RJYSYRSELCQCSO-REWHXWOFAB
4. Std. InChI: InChI=1S/C2HF3O2.Cs/c3-2(4,5)1(6)7;/h(H,6,7);/q;+1/p-1
5. Std. InChIKey: RJYSYRSELCQCSO-UHFFFAOYSA-M