3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole
ALDRICH/696641 - 95%
Synonym: 1,3-
CAS Number: 887144-97-0
Empirical Formula (Hill Notation): C10H10F3IO
Molecular Weight: 330.09
MDL Number: MFCD10567056
Linear Formula: C10H10F3IO
Product Type: Chemical
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 696641-1G
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 696641-5G
| assay | 95% |
| form | powder |
| functional group | fluoro |
| iodo | |
| InChI | 1S/C10H10F3IO/c1-9(2)7-5- |
| InChI key | HVAPLSNCVYXFDQ-UHFFFAOYSA |
| mp | 75-79 °C |
| Quality Level | 100  |
| reaction suitability | reaction type: C-C Bond Formation |
| SMILES string | CC1(C)O[I](c2ccccc12)C(F) |
| storage temp. | 2-8°C |
| Application: | Easily accessible hypervalent iodine compound acting as an electrophilic CF3-transfer reagent for direct, mild, and efficient trifluoromethylation. Trifluoromethylation of a variety of compounds including: • Secondary and primary aryl- and alkylphospines • Phenols • Peptides containing cysteine residudes by SPPS and electrophilic S-trifluoromethylation • Arenes and N-heterocycles • Electrophilic N-trifluoromethylation of Arozoles |
| Packaging: | 1, 5 g in glass bottle |
| Packaging: | 250 mg in glass bottle |
| Symbol |   GHS02,GHS07 |
| Signal word | Warning |
| Hazard statements | H228 - H315 - H319 - H335 |
| Precautionary statements | P210 - P302 + P352 - P305 + P351 + P338 |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36/37 |
| RIDADR | UN1325 - class 4.1 - PG 3 - Flammable solids, organic, n.o.s., H |
| WGK Germany | WGK 3 |
| Flash Point(F) | Not applicable |
| Flash Point(C) | Not applicable |
| Purity | 95% |
| mp | 75-79 °C |
| Storage Temp. | 2-8°C |
| UNSPSC | 12352101 |