-
Name
1,3-BENZODITHIOLYLIUM TETRAFLUOROBORATE
- EINECS
- CAS No. 57842-27-0
- Article Data3
- CAS DataBase
- Density
- Solubility
- Melting Point 150 °C (dec.)(lit.)
- Formula C7H5BF4S2
- Boiling Point
- Molecular Weight 240.053
- Flash Point
- Transport Information
- Appearance
- Safety 26-36
- Risk Codes 36/37/38
-
Molecular Structure
-
Hazard Symbols
Xi
- Synonyms 2-(Trifluoromethylthio)benzaldehyde;
- PSA 56.48000
- LogP 4.54390
1,3-Benzolithiolylium Tetrafluoroborate Specification
The CAS register number of 1,3-Benzolithiolylium Tetrafluoroborate is 57842-27-0. It also can be called as 2-(Trifluoromethylthio)benzaldehyde and the systematic name about this chemical is 1,3-benzodithiol-1-ium tetrafluoroborate. The molecular formula about this chemical is C7H5BF4S2 and the molecular weight is 240.05. It belongs to the following product categories which include Heterocyclic Compounds; Iodonium Sulfonium & Oxonium Compounds; Sulfonium Compounds; B (Classes of Boron Compounds); Biochemistry; Nucleosides, Nucleotides & Related Reagents; Protecting Agents for Hydroxyl and Amino Groups; Protecting Agents, Phosphorylating Agents & Condensing Agents; Protection & Derivatization Reagents (for Synthesis); Sulfur Compounds (for Synthesis); Synthetic Organic Chemistry; Tetrafluoroborates and so on.
When you are using 1,3-Benzolithiolylium Tetrafluoroborate, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. 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: F[B-](F)(F)F.[s+]1c2ccccc2sc1
(2)InChI: InChI=1/C7H5S2.BF4/c1-2-4-7-6(3-1)8-5-9-7;2-1(3,4)5/h1-5H;/q+1;-1
(3)InChIKey: CUSWPJQKCZMDPY-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C7H5S2.BF4/c1-2-4-7-6(3-1)8-5-9-7;2-1(3,4)5/h1-5H;/q+1;-1
(5)Std. InChIKey: CUSWPJQKCZMDPY-UHFFFAOYSA-N
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