Basic Information | Post buying leads | Suppliers |
Name |
Tetrabutylammonium fluoride trihydrate |
EINECS | 207-057-2 |
CAS No. | 87749-50-6 | Density | N/A |
PSA | 27.69000 | LogP | 1.81470 |
Solubility | soluble in water | Melting Point |
62-63 °C(lit.) |
Formula | C16H36FN.3(H2O) | Boiling Point | N/A |
Molecular Weight | 315.51 | Flash Point | -17℃ |
Transport Information | UN 1759 8/PG 1 | Appearance | white crystals or crystalline powder |
Safety | 26-36/37/39-45-26 | Risk Codes | 34-36/37/38 |
Molecular Structure | Hazard Symbols | C, Xi | |
Synonyms |
1-Butanaminium,N,N,N-tributyl-, fluoride, trihydrate (9CI);Tetrabutylammonium fluoride trihydrate;1-Butanaminium, N,N,N-tributyl-, fluoride, trihydrate;Tetra-N-butylammonium fluoride, trihydrate; |
The IUPAC name of 1-Butanaminium,N,N,N-tributyl-, fluoride, hydrate (1:1:3) is tetrabutylazanium fluoride trihydrate. With the CAS registry number 87749-50-6, it is also named as Tetra-N-butylammonium fluoride, trihydrate. Besides, it is white crystals or crystalline powder, which should be stored in closed, cool and dry place. This chemical is splitting blocking group, that is used as catalyst in silylanizingsilylation and elimination reaction. It is also used to produce seleno-aldehydes and sulfo-aldehydes. In addition, its molecular formula is C16H36FN.3(H2O) and molecular weight is 315.51.
The other characteristics of 1-Butanaminium,N,N,N-tributyl-, fluoride, hydrate (1:1:3) can be summarized as: (1)H-Bond Donor: 3; (2)H-Bond Acceptor: 4; (3)Rotatable Bond Count: 12; (4)Exact Mass: 315.314872; (5)MonoIsotopic Mass: 315.314872; (6)Topological Polar Surface Area: 3; (7)Heavy Atom Count: 21; (8)Complexity: 116; (9)EINECS: 207-057-2; (10)Melting Point: 62-63 °C.
When you are using this chemical, please be cautious about it as the following: it may cause burns. It is also irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. And you should wear suitable protective clothing, gloves and eye/face protection. Moreover, in case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
People can use the following data to convert to the molecule structure.
(1)SMILES: [F-].O.O.O.C([N+](CCCC)(CCCC)CCCC)CCC
(2)InChI: InChI=1/C16H36N.FH.3H2O/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;/h5-16H2,1-4H3;1H;3*1H2/q+1;;;;/p-1
(3)InChIKey: VEPTXBCIDSFGBF-REWHXWOFAY