| 4-Bromophenylacetonitrile Basic information |
| Product Name: | 4-Bromophenylacetonitrile |
| Synonyms: | (P-BROMOPHENYL)ACETONITRILE;P-BROMOBENZYL CYANIDE;2-(4-BROMOPHENYL)ACETONITRILE;4-BROMOBENZYL CYANIDE;4-BROMOPHENYLACETONITRILE;(p-bromophenyl)-acetonitril;1-BroMo-4-cyanoMethylbenzene;4-(CyanoMethyl)broMobenzene |
| CAS: | 16532-79-9 |
| MF: | C8H6BrN |
| MW: | 196.04 |
| EINECS: | 240-602-2 |
| Product Categories: | Phenyls & Phenyl-Het;Nitrile;blocks;Bromides;Aromatic Nitriles;Phenyls & Phenyl-Het;Carboxes;Aromatics;Miscellaneous Reagents |
| Mol File: | 16532-79-9.mol |
| 4-Bromophenylacetonitrile Chemical Properties |
| Melting point | 47-49 °C (lit.) |
| Boiling point | 116-118°C 3mm |
| density | 1.49 |
| refractive index | 1.6550 (estimate) |
| Fp | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| form | Crystalline Mass |
| color | Colorless to pale brown |
| Water Solubility | slightly soluble |
| BRN | 1861069 |
| Exposure limits | NIOSH: IDLH 25 mg/m3 |
| InChIKey | MFHFWRBXPQDZSA-UHFFFAOYSA-N |
| 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 |
| Hazard Codes | Xn,Xi |
| Risk Statements | 20/21/22-36/37/38-20/21/22/36/37/39 |
| Safety Statements | 26-36/37/39-38-26/36/37/39 |
| RIDADR | 3276 |
| WGK Germany | 3 |
| RTECS | AL8090000 |
| Hazard Note | Irritant |
| TSCA | Yes |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29269090 |
| MSDS Information |
| Provider | Language |
|---|---|
| 4-Bromobenzyl cyanide | English |
| ACROS | English |
| SigmaAldrich | English |
| ALFA | English |
| 4-Bromophenylacetonitrile Usage And Synthesis |
| Chemical Properties | colorless to pale brown crystalline mass |
| Uses | 4-Bromophenylacetonitrile is a chemical model used for the study and analysis of human buccal absorption of pharmaceuticals. |
| Uses | 4-Bromophenylacetonitrile has been used in the synthesis of :
|
| 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-. |
| 4-Bromophenylacetonitrile Preparation Products And Raw materials |
| Preparation Products | 7-BROMO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE-->4-Biphenylacetonitrile |
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