4-ETHOXYBENZONITRILE
- CAS NO.：25117-74-2
- Empirical Formula: C9H9NO
- Molecular Weight: 147.17
- MDL number: MFCD00001819
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-12-15 15:12:16
What is 4-ETHOXYBENZONITRILE?
Synthesis Reference(s)
Tetrahedron Letters, 34, p. 1581, 1993 DOI: 10.1016/0040-4039(93)85012-L
Properties of 4-ETHOXYBENZONITRILE
| Melting point: | 62-64 °C(lit.) |
| Boiling point: | 258 °C(lit.) |
| Density | 1.0921 (rough estimate) |
| refractive index | 1.5309 (estimate) |
| Flash point: | 258°C |
| form | powder to crystal |
| color | White to Light yellow |
| BRN | 2613602 |
| InChI | InChI=1S/C9H9NO/c1-2-11-9-5-3-8(7-10)4-6-9/h3-6H,2H2,1H3 |
| CAS DataBase Reference | 25117-74-2(CAS DataBase Reference) |
Safety information for 4-ETHOXYBENZONITRILE
| Signal word | Danger |
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H312:Acute toxicity,dermal H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H331:Acute toxicity,inhalation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P280:Wear protective gloves/protective clothing/eye protection/face protection. P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P405:Store locked up. |
Computed Descriptors for 4-ETHOXYBENZONITRILE
| InChIKey | PJRLUGQMEZZDIY-UHFFFAOYSA-N |
| SMILES | C(#N)C1=CC=C(OCC)C=C1 |
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![4-[(1-ACETYL-2-PHENYLVINYL)OXY]BENZENECARBONITRILE](https://img.chemicalbook.in/StructureFile/ChemBookStructure2/GIF/CB9764532.gif)
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