CALCIUM TRIFLUOROMETHANESULFONATE

The Calcium trifluoromethanesulfonate is an organic compound with the formula C₂CaF₆O₆S₂. The systematic name of this chemical is calcium bis(trifluoromethanesulfonate). With the CAS registry number 55120-75-7, it is also named as Methanesulfonic acid, 1,1,1-trifluoro-, calcium salt (2:1). The product's classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance]. Besides, it is a greyish powder, which should be stored in a closed cool and dry place.

Physical properties about Calcium trifluoromethanesulfonate are: (1)ACD/LogP: -0.37; (2)ACD/LogD (pH 5.5): -3.87; (3)ACD/LogD (pH 7.4): -3.87; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)Polar Surface Area: 62.75 Å²; (11)Boiling Point: 162 °C at 760 mmHg; (12)Vapour Pressure: 1.14 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed and can cause burns. Please take off immediately all contaminated clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: [Ca+2].FC(F)(F)S([O-])(=O)=O.FC(F)(F)S([O-])(=O)=O
(2)InChI: InChI=1/2CHF3O3S.Ca/c2*2-1(3,4)8(5,6)7;/h2*(H,5,6,7);/q;;+2/p-2
(3)InChIKey: PUQLFUHLKNBKQQ-NUQVWONBAC
(4)Std. InChI: InChI=1S/2CHF3O3S.Ca/c2*2-1(3,4)8(5,6)7;/h2*(H,5,6,7);/q;;+2/p-2
(5)Std. InChIKey: PUQLFUHLKNBKQQ-UHFFFAOYSA-L