3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole (CAS 887144-97-0) — formula C10H10F3IO, molecular weight 330.08; category organic chemicals.
3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole is a carbon-based organic compound with CAS registry number 887144-97-0 and molecular formula C10H10F3IO (molecular weight 330.08), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 887144-97-0
Its molecular formula C10H10F3IO comprises 10 C, 10 H, 3 F, 1 I, 1 O atoms.
Also known as: 3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole · Togni's Reagent
Category: organic chemicals
The CAS registry number of 3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole is 887144-97-0.
Molecular formula C10H10F3IO, molecular weight 330.08.
It is also registered under: 3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole, Togni's Reagent.
Category: Organic Chemicals.
Public-database records for 3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole (CAS 887144-97-0), reproduced here for independent cross-checking.
| Reported hazard statements | H228 (97.6%), H315 (100%), H319 (100%), H335 (97.6%) |
|---|
H228 (97.6%): Flammable solid [Danger Flammable solids]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
| CAS Registry Number | 887144-97-0 |
|---|---|
| PubChem CID | 16043572 |
| 分子式 | C10H10F3IO |
| IUPAC 名称 | 3,3-dimethyl-1-(trifluoromethyl)-1λ3,2-benziodoxole |
| UNII（FDA） | 3OK0E02MT6 |
887144-97-0; 3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole; 1-Trifluoromethyl-3,3-dimethyl-1,2-benziodoxole; 1,2-Benziodoxole, 3,3-dimethyl-1-(trifluoromethyl)-; 3OK0E02MT6; Togni's reagents dimethyl compound [MI]; RefChem:485454; TOGNI'S REAGENTS DIMETHYL COMPOUND; 626-754-6; Togni's Reagent; MFCD10567056; 1,3-Dihydro-3,3-dimethyl-1-(trifluoromethyl)-1,2-benziodoxole; Togni Reagent; UNII-3OK0E02MT6; 3,3-dimethyl-1-(trifluoromethyl)-1lambda3,2-benziodoxole; compound 1, Togni reagent I
| 分子量 | 330.08 |
|---|---|
| XLogP3 | 4 |
| 氢键供体数 | 0 |
| 氢键受体数 | 4 |
| 可旋转键数 | 0 |
| 精确质量 | 329.97285 |
| 单同位素质量 | 329.97285 |
| 拓扑极性表面积 | 9.2 |
| 重原子数 | 15 |
| 形式电荷 | 0 |
3,3-Dimethyl-1-(trifluoromethyl)-1,2-benziodoxole · CAS 887144-97-0 · C10H10F3IO. UNII 3OK0E02MT6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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