4-(Trifluoromethoxy)nitrobenzene
- CAS NO.：713-65-5
- Empirical Formula: C7H4F3NO3
- Molecular Weight: 207.11
- MDL number: MFCD00040302
- EINECS: 671-689-9
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-01-22 16:43:48
What is 4-(Trifluoromethoxy)nitrobenzene?
Chemical properties
Light yellow liquid
The Uses of 4-(Trifluoromethoxy)nitrobenzene
1-Nitro-4-(trifluoromethoxy)benzene can be used to manufacture tobacco flavor.
Synthesis Reference(s)
Journal of the American Chemical Society, 109, p. 3708, 1987 DOI: 10.1021/ja00246a030
Properties of 4-(Trifluoromethoxy)nitrobenzene
| Melting point: | 15°C |
| Boiling point: | 87 °C |
| Density | 1,447 g/cm3 |
| refractive index | 1.467 |
| Flash point: | 87-89°C/15mm |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Soluble), Methanol (Sparingly) |
| form | clear liquid |
| color | Light orange to Yellow to Green |
| Water Solubility | Not miscible or difficult to mix in water. |
| BRN | 1966388 |
| InChI | InChI=1S/C7H4F3NO3/c8-7(9,10)14-6-3-1-5(2-4-6)11(12)13/h1-4H |
| CAS DataBase Reference | 713-65-5(CAS DataBase Reference) |
| NIST Chemistry Reference | Alpha,alpha,alpha-trifluoro-4'-nitroanisole(713-65-5) |
Safety information for 4-(Trifluoromethoxy)nitrobenzene
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. 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-(Trifluoromethoxy)nitrobenzene
| InChIKey | UBEIKVUMDBCCRW-UHFFFAOYSA-N |
| SMILES | C1([N+]([O-])=O)=CC=C(OC(F)(F)F)C=C1 |
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