Basic Information | Post buying leads | Suppliers |
Name |
Yttrium(III) trifluoromethanesulfonate |
EINECS | N/A |
CAS No. | 52093-30-8 | Density | 1.7 |
PSA | 196.74000 | LogP | 3.39660 |
Solubility | Soluble in water | Melting Point |
N/A |
Formula | C3F9O9S3Y | Boiling Point | 162 °C at 760 mmHg |
Molecular Weight | 536.11 | Flash Point | N/A |
Transport Information | N/A | Appearance | white crystalline powder |
Safety | 26-36 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
yttrium tris(trifluoromethanesulfonate);methanesulfonic acid, 1,1,1-trifluoro-, yttrium(3+) salt (3:1);Trifluoromethanesulfonic acid yttrium(III) salt;Yttrium (III) trifluoromethanesulphonate;Yttrium triflate; |
The Yttrium(III) trifluoromethanesulfonate, with the CAS registry number 52093-30-8, has the systematic name of yttrium tris(trifluoromethanesulfonate). It is a kind of white crystalline powder, and belongs to the following product categories: Y (Yttrium) Compounds; Catalysts for Organic Synthesis; Classes of Metal Compounds; Homogeneous Catalysts; Metal Triflates; Synthetic Organic Chemistry; Transition Metal Compounds; Trifluoromethanesulfonate. And the molecular formula of the chemical is C3F9O9S3Y.
The characteristics of Yttrium(III) trifluoromethanesulfonate are as followings: (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)Boiling Point: 162 °C at 760 mmHg; (14)Vapour Pressure: 1.14 mmHg at 25°C.
You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Y+3].FC(F)(F)S([O-])(=O)=O.FC(F)(F)S([O-])(=O)=O.FC(F)(F)S([O-])(=O)=O
(2)InChI: InChI=1/3CHF3O3S.Y/c3*2-1(3,4)8(5,6)7;/h3*(H,5,6,7);/q;;;+3/p-3
(3)InChIKey: JPJIEXKLJOWQQK-DFZHHIFOAV