4-Methoxybenzyl cyanide
Synonym(s):4-Methoxybenzyl cyanide
- CAS NO.：104-47-2
- Empirical Formula: C9H9NO
- Molecular Weight: 147.17
- MDL number: MFCD00001919
- EINECS: 203-206-0
- SAFETY DATA SHEET (SDS)
- Update Date: 2023-08-21 17:50:07
What is 4-Methoxybenzyl cyanide?
Chemical properties
Clear colorless to slightly yellow liquid
The Uses of 4-Methoxybenzyl cyanide
4-Methoxybenzyl cyanide is used in the biosynthesis of p-methoxyphenylacetic acid by immobilized Bacillus subtilis ZJB-063.
The Uses of 4-Methoxybenzyl cyanide
4-Methoxyphenylacetonitrile was used as starting reagent in the synthesis of :
- 2-(1-cyano-1-(2-methoxy)phenyl)methylidene-3-phenylthiazolidine-4,5-dione
- 2-(1-cyano-1-(4-methoxy)-phenyl)methylidene-3-phenylthiazolidine-4,5-dione
- α-cyanostilbenes
Synthesis Reference(s)
Journal of Medicinal Chemistry, 15, p. 214, 1972 DOI: 10.1021/jm00272a029
Synthesis, p. 40, 1987 DOI: 10.1055/s-1987-27834
General Description
4-Methoxyphenylacetonitrile has been isolated from the sponge Psammaplysilla purpurea.
Properties of 4-Methoxybenzyl cyanide
| Melting point: | 8 °C |
| Boiling point: | 286-287 °C (lit.) |
| Density | 1.085 g/mL at 25 °C (lit.) |
| refractive index | n |
| Flash point: | >230 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | 0.01g/l |
| form | Liquid |
| color | Clear colorless to slightly yellow |
| Specific Gravity | 1.085 |
| PH | 4.5 (100g/l, H2O, 20℃)suspension |
| explosive limit | 1.2-9.4%(V) |
| BRN | 509162 |
| Exposure limits | NIOSH: IDLH 25 mg/m3 |
| CAS DataBase Reference | 104-47-2(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzeneacetonitrile, 4-methoxy-(104-47-2) |
| EPA Substance Registry System | Benzeneacetonitrile, 4-methoxy- (104-47-2) |
Safety information for 4-Methoxybenzyl cyanide
| Signal word | Danger |
| Pictogram(s) |
 Skull and Crossbones Acute Toxicity GHS06 |
| GHS Hazard Statements |
H301:Acute toxicity,oral H412:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P273:Avoid release to the environment. |
Computed Descriptors for 4-Methoxybenzyl cyanide
| InChIKey | PACGLQCRGWFBJH-UHFFFAOYSA-N |
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