4-Bromophenylacetonitrile
Synonym(s):4-Bromobenzyl cyanide
- CAS NO.：16532-79-9
- Empirical Formula: C8H6BrN
- Molecular Weight: 196.04
- MDL number: MFCD00001916
- EINECS: 240-602-2
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-09-05 22:20:32
What is 4-Bromophenylacetonitrile?
Chemical properties
colorless to pale brown crystalline mass
The Uses of 4-Bromophenylacetonitrile
4-Bromophenylacetonitrile is a chemical model used for the study and analysis of human buccal absorption of pharmaceuticals.
The Uses of 4-Bromophenylacetonitrile
4-Bromophenylacetonitrile has been used in the synthesis of :
- new fluorene-based alternating polymers
- light-emitting copolymer, poly(N 4,N 4-bis-(4-phenyl)-N 4,N 4′-bis-[4-(2-ethylhexyloxy)phenyl]-biphenyl-4,4′-diamine-co-1,2-bis(4′-phenyl)-1-(9′′,9′′-dihexyl-3-fluorenyl)ethane) using a Yamamoto coupling reaction
- N-methyl-3,4-bis(4-(N-(1-naphthyl)phenylamino)phenyl)maleimide, a novel non-doped red organic light-emitting diode (OLED) material
What are the applications of Application
4-Bromophenylacetonitrile is used in the synthesis of new fluorene-based alternating polymers
General Description
4-Bromophenylacetonitrile undergoes reduction using 1,1,3,3-tetramethyldisiloxane activated by a non-toxic titanium(IV) isopropoxide to yield 4-bromophenylethylamine.
Safety Profile
Poison by intravenous route. See also BROMIDES and NITRILES. When heated to decomposition it emits very toxic fumes of Br-, NOx, and CN-.
Properties of 4-Bromophenylacetonitrile
| Melting point: | 47-49 °C (lit.) |
| Boiling point: | 116-118°C 3mm |
| Density | 1.49 |
| refractive index | 1.6550 (estimate) |
| Flash point: | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Sparingly), Ethyl Acetate (Sparingly) |
| form | Crystalline Mass |
| color | Colorless to pale brown |
| Water Solubility | slightly soluble |
| BRN | 1861069 |
| Exposure limits | NIOSH: IDLH 25 mg/m3 |
| CAS DataBase Reference | 16532-79-9(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzeneacetonitrile, 4-bromo-(16532-79-9) |
| EPA Substance Registry System | 4-Bromobenzyl cyanide (16532-79-9) |
Safety information for 4-Bromophenylacetonitrile
| Signal word | Danger |
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06 |
| GHS Hazard Statements |
H301:Acute toxicity,oral H311: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. P309:IF exposed or if you feel unwell: P310:Immediately call a POISON CENTER or doctor/physician. P361:Remove/Take off immediately all contaminated clothing. P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 4-Bromophenylacetonitrile
| InChIKey | MFHFWRBXPQDZSA-UHFFFAOYSA-N |
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