Name: MERCURY(II) TRIFLUOROMETHANESULFONATE
SKU: 49540-00-3

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Basic Information

Molecular Structure:
CAS No.:	49540-00-3
Name:	MERCURY(II) TRIFLUOROMETHANESULFONATE
Article Data:	13

Formula:	C₂F₆HgO₆S₂
Molecular Weight:	498.731
Synonyms:	Methanesulfonicacid, trifluoro-, mercury(2+) salt (9CI);Mercuric triflate;Mercuric trifluoromethanesulfonate;Mercury bis(trifluoromethanesulfonate);Mercury(2+)bis(trifluoromethanesulfonate);Mercury(2+) triflate;Mercury(II) triflate;Mercury(II) trifluoromethanesulfonate;Trifluoromethanesulfonic acidmercury(2+) salt;
Melting Point:	>350 °C
Boiling Point:	162 °C at 760 mmHg
Hazard Symbols:	T+,N,T,C
Risk Codes:	26/27/28-33-50/53
Safety:	13-28-36-45-60-61
Transport Information:	UN 2025
PSA:	131.16000
LogP:	2.26190

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Specification

The Mercury(II) trifluoromethanesulphonate, with the CAS registry number 49540-00-3, is also known as Mercury(II) trifluoromethanesulphonate 98% and Methanesulfonic acid, 1,1,1-trifluoro-, mercury salt (2:1). It belongs to the product categories of Catalysis and Inorganic Chemistry; Chemical Synthesis; Mercury. This chemical's molecular formula is C₂F₆HgO₆S₂ and formula weight is 498.73. What's more, its systematic name is called Mercury bis(trifluoromethanesulfonate).

Physical properties about this chemical are: (1)ACD/LogP: -0.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.87; (4)ACD/LogD (pH 7.4): -3.87; (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: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 62.75 Å²; (13)Melting Point: >350 °C; (14)Boiling Point: 162 °C at 760 mmHg; (15)Vapour Pressure: 1.14 mmHg at 25°C; (16)Sensitive: moisture sensitive.

When you are using this chemical, please be cautious about it as the following:
This chemical that at very low levels may cause damage to health and may present an immediate or delayed danger to one or more components of the environment. Besides, it may destroy living tissue on contact. Very toxic by inhalation, in contact with skin and if swallowed. What's more, it id very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. This chemical should be kept away from food, drink and animal feeding stuffs. After contact with skin, you should wash immediately with plenty of ... (to be specified by the manufacturer). 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: [Hg+2].FC(F)(F)S([O-])(=O)=O.FC(F)(F)S([O-])(=O)=O
(2)InChI: InChI=1/2CHF3O3S.Hg/c2*2-1(3,4)8(5,6)7;/h2*(H,5,6,7);/q;;+2/p-2
(3)InChIKey: BPVYMDMPLCOQPJ-NUQVWONBAL